SCHEMBL2351674

SCHEMBL2351674

COCOC1CN(C(=O)OC(C)(C)C)CCC1CO

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.45
HPGD P15428 1/20 0.44
RECQL P46063 1/20 0.42
EPHX1 P07099 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GPR119 Q8TDV5 3/20 0.40
KDM4E B2RXH2 2/20 0.39
THRB P10828 1/20 0.39
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
PKM P14618 1/20 0.39
PDE4B Q07343 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2351668 1.00 NR1H2 (0.45) NR1H2HPGDRECQLEPHX1ALDH1A1
SCHEMBL2354787 1.00 NR1H2 (0.45) NR1H2HPGDRECQLEPHX1ALDH1A1
SCHEMBL18314503 0.91 HPGD (0.43) NR1H2HPGDRECQLEPHX1ALDH1A1
SCHEMBL2349492 0.91 NR1H2 (0.44) NR1H2HPGDRECQLEPHX1ALDH1A1
SCHEMBL2349491 0.91 NR1H2 (0.44) NR1H2HPGDRECQLEPHX1ALDH1A1
SCHEMBL17032300 0.91 HPGD (0.43) NR1H2HPGDRECQLEPHX1ALDH1A1
SCHEMBL13478901 0.89 NR1H2 (0.50) NR1H2HPGDRECQLEPHX1ALDH1A1
SCHEMBL13393217 0.89 NR1H2 (0.50) NR1H2HPGDRECQLEPHX1ALDH1A1
SCHEMBL10305452 0.89 NR1H2 (0.50) NR1H2HPGDRECQLEPHX1ALDH1A1
SCHEMBL2382722 0.87 HPGD (0.40) HPGDRECQLEPHX1ALDH1A1MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11566029-B2 Pyrazolo[1,5-a]pyrimidine-5,7-diamine compounds as CDK inhibitors and their therapeutic use IP2IPO INNOVATIONS LIMITED (GB) 2023-01-31 US disclosed
US-20210253583-A1 PYRAZOLO[1,5-A]PYRIMIDINE-5,7-DIAMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE IP2IPO INNOVATIONS LIMITED (GB) 2021-08-19 US disclosed
US-10927119-B2 Pyrazolo[1,5-a]pyrimidine-5,7-diamine compounds as CDK inhibitors and their therapeutic use IP2IPO INNOVATIONS LIMITED (GB) 2021-02-23 US disclosed
US-20200055862-A1 PYRAZOLO[1,5-A]PYRIMIDINE-5,7-DIAMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE EMORY UNIVERSITY 2020-02-20 US disclosed
US-10414772-B2 Pyrazolo[1,5-A]pyrimidine-5,7-diamine compounds as CDK inhibitors and their therapeutic use IMPERIAL INNOVATIONS LIMITED (GB) 2019-09-17 US disclosed
EP-3107914-B1 PYRAZOLO[1,5-A]PYRIMIDINE-5,7-DIAMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE CANCER RESEARCH TECH LTD (GB) 2019-01-30 EP disclosed
US-20180273540-A1 PYRAZOLO[1,5-A]PYRIMIDINE-5,7-DIAMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE IP2IPO INNOVATIONS LIMITED (GB) 2018-09-27 US disclosed
US-9932344-B2 Pyrazolo[1,5-A]pyrimidine-5,7-diamine compounds as CDK inhibitors and their therapeutic use CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-04-03 US disclosed
US-20160362410-A1 PYRAZOLO[1,5-A]PYRIMIDINE-5,7-DIAMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE IP2IPO INNOVATIONS LIMITED (GB) 2016-12-15 US disclosed
EP-2536283-B1 PHENYL-HETEROARYL DERIVATIVES AND METHODS OF USE THEREOF TRANSTECH PHARMA LLC (US) 2015-07-29 EP disclosed
US-20130197007-A1 Phenyl-Heteroaryl Derivatives and Methods of Use Thereof TRANSTECH PHARMA, INC. (US) 2013-08-01 US disclosed
US-8431575-B2 Phenyl-heteroaryl derivatives and methods of use thereof TRANSTECH PHARMA, INC. (US) 2013-04-30 US disclosed
EP-2536283-A1 PHENYL-HETEROARYL DERIVATIVES AND METHODS OF USE THEREOF TransTech Pharma, Inc (US) 2012-12-26 EP disclosed
US-20110230458-A1 PHENYL-HETEROARYL DERIVATIVES AND METHODS OF USE THEREOF TRANSTECH PHARMA, INC. (US) 2011-09-22 US disclosed
WO-2011103091-A1 PHENYL-HETEROARYL DERIVATIVES AND METHODS OF USE THEREOF TRANSTECH PHARMA, INC. (US) 2011-08-25 WO disclosed
US-6509003-B2 N-alkylpiperidine derivatives labeled with radioactive iodine; use in single photon emission computed tomography (SPECT) DAIICHI PURE CHEMICALS CO., LTD. (JP) 2003-01-21 US disclosed
EP-0989120-B1 REAGENTS FOR ASSAYING CENTRAL LOCAL ACETYLCHOLINESTERASE ACTIVITY DAIICHI PURE CHEMICALS CO LTD (JP) 2003-01-15 EP disclosed
US-20020127180-A1 Reagents for the determination of cerebral regional acetylcholinesterase activity DAIICHI PURE CHEMICALS CO., LTD (JP) 2002-09-12 US disclosed
US-6306882-B1 FLUOROALKYLPIPERIDINE ESTERS COGNITION ACTIVATORS AND ALZHEIMER'S DAIICHI PURE CHEMICALS CO., LTD. (JP) 2001-10-23 US disclosed
EP-0989120-A1 REAGENTS FOR ASSAYING CENTRAL LOCAL ACETYLCHOLINESTERASE ACTIVITY DAIICHI PURE CHEMICALS CO., LTD. (JP) 2000-03-29 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210253583-A1 PYRAZOLO[1,5-A]PYRIMIDINE-5,7-DIAMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE CDK10, CDK1, CDK20 NR1H2 2619/4885HPGD 2147/4885RECQL 1816/4885
US-20110230458-A1 PHENYL-HETEROARYL DERIVATIVES AND METHODS OF USE THEREOF AGER, PSEN2, PSEN1 NR1H2 249/4885HPGD 218/4885RECQL 1279/4885
US-10927119-B2 Pyrazolo[1,5-a]pyrimidine-5,7-diamine compounds as CDK inhibitors and their therapeutic use CDK10, CDK1, CDK20 NR1H2 2619/4885HPGD 2147/4885RECQL 1816/4885
US-20200055862-A1 PYRAZOLO[1,5-A]PYRIMIDINE-5,7-DIAMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE CDK10, CDK1, CDK20 NR1H2 2619/4885HPGD 2147/4885RECQL 1816/4885
US-20160362410-A1 PYRAZOLO[1,5-A]PYRIMIDINE-5,7-DIAMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE CDK10, CDK1, CDK20 NR1H2 2257/4885HPGD 2092/4885RECQL 2442/4885
US-20130197007-A1 Phenyl-Heteroaryl Derivatives and Methods of Use Thereof AGER, PSEN2, PSEN1 NR1H2 249/4885HPGD 218/4885RECQL 1279/4885
US-20180273540-A1 PYRAZOLO[1,5-A]PYRIMIDINE-5,7-DIAMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE CDK10, CDK1, CDK20 NR1H2 2619/4885HPGD 2147/4885RECQL 1816/4885
US-20020127180-A1 Reagents for the determination of cerebral regional acetylcholinesterase activity ACHE, BCHE, CHAT NR1H2 828/4885HPGD 1349/4885RECQL 1657/4885
US-11566029-B2 Pyrazolo[1,5-a]pyrimidine-5,7-diamine compounds as CDK inhibitors and their therapeutic use CDK10, CDK1, CDK20 NR1H2 2619/4885HPGD 2147/4885RECQL 1816/4885
US-10414772-B2 Pyrazolo[1,5-A]pyrimidine-5,7-diamine compounds as CDK inhibitors and their therapeutic use CDK10, CDK1, CDK20 NR1H2 2619/4885HPGD 2147/4885RECQL 1816/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.