SCHEMBL17624331

SCHEMBL17624331

CC(=O)N1CCC2(CC1)CN(C)C2

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 7/20 0.54
CYP2C19 P33261 2/20 0.54
MAPK1 P28482 1/20 0.54
CYP1A2 P05177 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
CYP2C9 P11712 3/20 0.51
USP2 O75604 5/20 0.51
HPGD P15428 5/20 0.51
HSD17B10 Q99714 5/20 0.51
HIF1A Q16665 2/20 0.51
TSHR P16473 2/20 0.51
CYP3A4 P08684 3/20 0.50
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP2D6 P10635 6/20 0.45

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
SCHEMBL19504703 0.89 OPRM1 (0.47) KDM4EALDH1A1CYP2C19MAPK1CYP1A2
SCHEMBL8330359 0.89 USP2 (0.54) KDM4EALDH1A1CYP2C19MAPK1CYP1A2
SCHEMBL18711889 0.88 USP2 (0.49) ALDH1A1CYP2C19MAPK1CYP1A2TDP1
SCHEMBL15632465 0.84 CYP1A2 (0.62) KDM4EALDH1A1CYP2C19MAPK1CYP1A2
SCHEMBL26783934 0.84 USP2 (0.60) KDM4EALDH1A1CYP2C19MAPK1CYP1A2
SCHEMBL20472810 0.83 USP2 (0.47) ALDH1A1CYP2C19MAPK1CYP2C9USP2
SCHEMBL18390599 0.83 CYP1A2 (0.54) KDM4EALDH1A1CYP2C19MAPK1CYP1A2
SCHEMBL15544126 0.81 USP2 (0.58) KDM4EALDH1A1CYP2C19MAPK1CYP1A2
SCHEMBL23763347 0.81 CYP1A2 (0.52) ALDH1A1CYP2C19MAPK1CYP1A2TDP1
SCHEMBL30499286 0.81 USP2 (0.46) ALDH1A1CYP2C19MAPK1CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4223754-A1 COMPOUND AS AKT KINASE INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-08-09 EP disclosed
WO-2023125707-A1 P38 MAPK/MK2 PATHWAY REGULATOR, COMPOSITION THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF 上海美悦生物科技发展有限公司 2023-07-06 WO disclosed
US-20230203007-A1 PYRIDINYLACETAMIDE DERIVATIVES AS SODIUM CHANNEL ACTIVATORS X-CHEM GLOBAL HQ 2023-06-29 US disclosed
US-20230203007-A1 PYRIDINYLACETAMIDE DERIVATIVES AS SODIUM CHANNEL ACTIVATORS X-CHEM GLOBAL HQ 2023-06-29 US disclosed
US-20230174487-A1 PHENYLPROPIONAMIDE COMPOUND AND USE THEREOF MEDSHINE DISCOVERY INC. (CN) 2023-06-08 US disclosed
WO-2023098656-A1 COMPOUNDS FOR THE DEGRADATION OF EGFR KINASE BEIGENE, LTD. (GB) 2023-06-08 WO disclosed
WO-2021159993-A1 INHIBITORS OF INTERLEUKIN-1 RECEPTOR ASSOCIATED KINASE (IRAK) /FMS-LIKE RECEPTOR TYROSINE KINASE (FLT3), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF PHARMABLOCK SCIENCES (NANJING) , INC. (CN) 2021-08-19 WO disclosed
WO-2021136354-A1 BIPHENYL DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2021-07-08 WO disclosed
EP-3377060-B1 PYRAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND USES THEREOF LUNDBECK LA JOLLA RESEARCH CENTER INC (US) 2020-08-19 EP disclosed
WO-2020037079-A1 SUBSTITUTED INDOLES AND METHODS OF USE THEREOF Epizyme, Inc. (US) 2020-02-20 WO disclosed
US-20170305922-A1 CARM1 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-10-26 US disclosed
WO-2016044604-A1 CARM1 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-03-24 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 (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-20170305922-A1 CARM1 INHIBITORS AND USES THEREOF CARM1, ADRM1, PRMT1 KDM4E 892/4885ALDH1A1 1286/4885CYP2C19 3703/4885
US-20230174487-A1 PHENYLPROPIONAMIDE COMPOUND AND USE THEREOF PAH, TRPV1, TRPA1 KDM4E 2215/4885ALDH1A1 399/4885CYP2C19 79/4885
US-20230203007-A1 PYRIDINYLACETAMIDE DERIVATIVES AS SODIUM CHANNEL ACTIVATORS SCN1A, SCN3A, SCN2A KDM4E 2085/4885ALDH1A1 1110/4885CYP2C19 564/4885

“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.