SCHEMBL442931

SCHEMBL442931

COCNC(=O)C1CCCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.57
ALDH1A1 P00352 1/20 0.57
MAPT P10636 1/20 0.57
KMT2A Q03164 1/20 0.57
HPGD P15428 1/20 0.49
ITGB3 P05106 11/20 0.45
ITGA2B P08514 11/20 0.45
EPHX1 P07099 1/20 0.44
ABL1 P00519 1/20 0.43
RIN1 Q13671 1/20 0.43
GLS O94925 1/20 0.42
F2R P25116 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
MMP1 P03956 1/20 0.41
MMP9 P14780 1/20 0.41
MMP13 P45452 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
SCHEMBL15049749 1.00 MEN1 (0.57) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL1156346 0.92 HPGD (0.51) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL1155860 0.92 HPGD (0.51) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL389961 0.92 HPGD (0.51) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL30229920 0.88 MAPT (0.55) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL22412622 0.87 ALDH1A1 (0.60) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL18768309 0.87 ALDH1A1 (0.60) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL1309545 0.86 NR1H2 (0.47) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL413795 0.85 HPGD (0.55) KMT2AHPGDEPHX1ABL1RIN1
SCHEMBL30919787 0.85 MEN1 (0.55) MEN1ALDH1A1MAPTKMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11505526-B2 Aryl-piperidine derivatives ARTAX BIOPHARMA INC. (US) 2022-11-22 US disclosed
US-20200131125-A1 ARYL-PIPERIDINE DERIVATIVES ARTAX BIOPHARMA INC. 2020-04-30 US disclosed
WO-2018170078-A1 ARYL-PIPERIDINE DERIVATIVES ARTAX BIOPHARMA, INC. (US) 2018-09-20 WO disclosed
EP-3375778-A1 ARYL-PIPERIDINE DERIVATIVES Artax Biopharma Inc. (US) 2018-09-19 EP disclosed
US-9856236-B2 Substituted quinoxalines as FGFR kinase inhibitors ASTEX THERAPEUTICS LTD (GB) 2018-01-02 US disclosed
EP-2684871-B1 Heteroaryl pyrrolidinyl and piperidinyl ketone derivatives HOFFMANN LA ROCHE (CH) 2016-05-04 EP disclosed
US-9290478-B2 Substituted quinoxalines as FGFR kinase inhibitors ASTEX THERAPEUTICS LTD (GB) 2016-03-22 US disclosed
US-20160031856-A1 SUBSTITUTED QUINOXALINES AS FGFR KINASE INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2016-02-04 US disclosed
US-9145394-B2 2015-09-29 US disclosed
EP-2646432-B1 SUBSTITUTED BENZOPYRAZIN DERIVATIVES AS FGFR KINASE INHIBITORS FOR THE TREATMENT OF CANCER DISEASES ASTEX THERAPEUTICS LTD (GB) 2015-04-08 EP disclosed
EP-2684871-A1 Heteroaryl pyrrolidinyl and piperidinyl ketone derivatives F. Hoffmann-La Roche AG (CH) 2014-01-15 EP disclosed
US-20130267525-A1 SUBSTITUTED BENZOPYRAZIN DERIVATIVES AS FGFR KINASE INHIBITORS FOR THE TREATMENT OF CANCER DISEASES ASTEX THERAPEUTICS LIMITED (GB) 2013-10-10 US disclosed
US-8513425-B2 Heteroaryl pyrrolidinyl and piperidinyl ketone derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2013-08-20 US disclosed
US-20120065225-A1 HETEROARYL PYRROLIDINYL AND PIPERIDINYL KETONE DERIVATIVES AND USES THEREOF IYER PRAVIN (US) 2012-03-15 US disclosed
US-8084623-B2 heterocyclic ketones such as (3-Benzyl-pyrrolidin-3-yl)-(1H-indol-5-yl)-methanone, used as antidepressants or anxiolytic agents ROCHE PALO ALTO LLC (US) 2011-12-27 US disclosed
EP-2354124-A2 Heteroaryl pyrrolidinyl and piperidinyl ketone derivatives F. Hoffmann-La Roche AG (CH) 2011-08-10 EP disclosed
EP-2102157-B1 HETEROARYL PYRROLIDINYL AND PIPERIDINYL KETONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-06-22 EP disclosed
US-20090318493-A1 Aryl pyrrolidinyl and piperidinyl ketone derivatives and uses thereof ROCHE PALO ALTO LLC 2009-12-24 US disclosed
US-20080146607-A1 Heteroaryl pyrrolidinyl and piperidinyl ketone derivatives and uses thereof ROCHE PALO ALTO LLC 2008-06-19 US disclosed
WO-2007039782-A1 TETRAZOLE DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2007-04-12 WO 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 (7 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-20120065225-A1 HETEROARYL PYRROLIDINYL AND PIPERIDINYL KETONE DERIVATIVES AND USES THEREOF CNKSR1, RB1, AR MEN1 1757/4885ALDH1A1 447/4885MAPT 3385/4885
US-11505526-B2 Aryl-piperidine derivatives CD4, CD2, CCR1 MEN1 4814/4885ALDH1A1 1450/4885MAPT 4223/4885
US-20080146607-A1 Heteroaryl pyrrolidinyl and piperidinyl ketone derivatives and uses thereof CNKSR1, RB1, AR MEN1 1757/4885ALDH1A1 447/4885MAPT 3385/4885
US-20200131125-A1 ARYL-PIPERIDINE DERIVATIVES CD4, CD2, CCR1 MEN1 4814/4885ALDH1A1 1450/4885MAPT 4223/4885
US-20090318493-A1 Aryl pyrrolidinyl and piperidinyl ketone derivatives and uses thereof TPH2, TPH1, ADRA2C MEN1 4004/4885ALDH1A1 861/4885MAPT 995/4885
US-20160031856-A1 SUBSTITUTED QUINOXALINES AS FGFR KINASE INHIBITORS FGFR1, FGFR3, ABL1 MEN1 1732/4885ALDH1A1 2079/4885MAPT 2422/4885
US-20130267525-A1 SUBSTITUTED BENZOPYRAZIN DERIVATIVES AS FGFR KINASE INHIBITORS FOR THE TREATMENT OF CANCER DISEASES FGFR1, FGFR4, FGFR3 MEN1 2061/4885ALDH1A1 1649/4885MAPT 2615/4885

“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.