SCHEMBL27119401

SCHEMBL27119401

COc1cc2c(cc1-c1ccn(C)n1)-c1c(c(C(=O)N3CCOCC3(C)C)nn1-c1cc(Cl)cc(Cl)c1)CC2

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 2/20 0.36
▸ PIK3CD O00329 15/20 0.36
▸ PIK3R2 O00459 15/20 0.36
▸ PIK3CA P42336 15/20 0.36
▸ PIK3CB P42338 15/20 0.36
▸ PIK3CG P48736 15/20 0.36
▸ PIK3R5 Q8WYR1 15/20 0.36
▸ PIK3R3 Q92569 15/20 0.36
▸ RAD52 P43351 1/20 0.34
▸ UGCG Q16739 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL30759601 1.00 GRM5 (0.36) GRM5PIK3CDPIK3R2PIK3CAPIK3CB
SCHEMBL20988952 0.96 GRM5 (0.35) GRM5PIK3CDPIK3R2PIK3CAPIK3CB
SCHEMBL20988922 0.95 GRM5 (0.34) GRM5PIK3CDPIK3R2PIK3CAPIK3CB
SCHEMBL27118795 0.95 GRM5 (0.37) GRM5PIK3CDPIK3R2PIK3CAPIK3CB
SCHEMBL27117920 0.88 GRM5 (0.37) GRM5PIK3CDPIK3R2PIK3CAPIK3CB
SCHEMBL17381585 0.88 GRM5 (0.36) GRM5PIK3CDPIK3R2PIK3CAPIK3CB
SCHEMBL27118049 0.88 GRM5 (0.35) GRM5PIK3CDPIK3R2PIK3CAPIK3CB
SCHEMBL30759592 0.88 GRM5 (0.38) GRM5PIK3CDPIK3R2PIK3CAPIK3CB
SCHEMBL27119377 0.88 GRM5 (0.38) GRM5PIK3CDPIK3R2PIK3CAPIK3CB
SCHEMBL27123287 0.86 PIK3CD (0.39) GRM5PIK3CDPIK3R2PIK3CAPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024044778-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF CELMATIX INC. (US) 2024-02-29 — — WO disclosed
WO-2024044778-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF CELMATIX INC. (US) 2024-02-29 — — WO disclosed
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