SCHEMBL16015485

SCHEMBL16015485

CN(C)CCC(=O)N1CCN(C)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.46
KMT2A Q03164 2/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NAMPT P43490 1/20 0.45
TDP1 Q9NUW8 2/20 0.45
CYP1A2 P05177 1/20 0.45
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
CYP3A4 P08684 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
GNAI3 P08754 3/20 0.42
GNAO1 P09471 3/20 0.42
GNAI1 P63096 3/20 0.42
NPC1 O15118 1/20 0.41
ACKR3 P25106 1/20 0.41

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
SCHEMBL12259091 0.89 SIGMAR1 (0.48) HTR1AKMT2AHTTSMN1; SMN2TDP1
SCHEMBL14079956 0.85 HTR1A (0.52) HTR1AKMT2AHTTSMN1; SMN2TDP1
SCHEMBL11948184 0.83 ATM (0.52) KMT2ASMN1; SMN2NAMPTTDP1KDM4E
SCHEMBL18830602 0.83 ATM (0.58) KMT2ASMN1; SMN2NAMPTTDP1KDM4E
SCHEMBL14079955 0.83 HTR1A (0.46) HTR1AKMT2AHTTSMN1; SMN2TDP1
SCHEMBL14079939 0.82 KMT2A (0.41) HTR1AKMT2AHTTSMN1; SMN2TDP1
SCHEMBL3918700 0.82 ATM (0.56) KMT2AHTTSMN1; SMN2NAMPTTDP1
SCHEMBL12141608 0.81 HSD11B1 (0.53) KMT2ANAMPTTDP1KDM4EMEN1
SCHEMBL13601664 0.80 DNM1 (0.46) HTR1AKMT2AHTTSMN1; SMN2CYP1A2
SCHEMBL2481091 0.80 NPC1 (0.41) KMT2ASMN1; SMN2NAMPTTDP1KDM4E

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023083194-A1 WEE1 PROTEIN KINASE DEGRADATION AGENT AND USE THEREOF 杭州格博生物医药有限公司 2023-05-19 WO disclosed
US-20210047328-A1 PYRIMIDINE-BASED ANTIPROLIFERATIVE AGENTS G1 THERAPEUTICS, INC. (US) 2021-02-18 US disclosed
EP-3322706-B1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2020-11-11 EP disclosed
WO-2018136661-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRAZINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-07-26 WO disclosed
US-20180015120-A1 Self-assembling monomers and oligomers as surface-modifying endgroups for polymers DSM IP ASSETS BV (NL) 2018-01-18 US disclosed
US-20170096425-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA, INC. 2017-04-06 US disclosed
WO-2017011776-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA, INC. (US) 2017-01-19 WO disclosed
US-8889706-B2 Soluble mTOR complexes and modulators thereof WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2014-11-18 US disclosed
US-8829012-B2 CDK inhibitors G1 THERAPEUTICS, INC. (US) 2014-09-09 US 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 (3 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-20210047328-A1 PYRIMIDINE-BASED ANTIPROLIFERATIVE AGENTS TYMP, TYMS, DPYD HTR1A 4133/4885KMT2A 1422/4885HTT 2485/4885
US-20170096425-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF HTR1A 2573/4885KMT2A 1448/4885HTT 4246/4885
US-20180015120-A1 Self-assembling monomers and oligomers as surface-modifying endgroups for polymers MLX, SRRM2, LIMA1 HTR1A 1110/4885KMT2A 4068/4885HTT 4030/4885

“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.