SCHEMBL30759519

SCHEMBL30759519

COc1cc2c(cc1Br)-c1c(c(C(=O)N3CCOCC3(C)C)nn1-c1cc(Cl)cc(Cl)c1)SC2

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 3/20 0.36
▸ PTGS2 P35354 4/20 0.35
▸ PTGS1 P23219 2/20 0.35
▸ GLA P06280 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ PIK3CD O00329 1/20 0.31
▸ PIK3R2 O00459 1/20 0.31
▸ PIK3CA P42336 1/20 0.31
▸ PIK3CB P42338 1/20 0.31
▸ PIK3CG P48736 1/20 0.31
▸ PIK3R5 Q8WYR1 1/20 0.31
▸ PIK3R3 Q92569 1/20 0.31
▸ PDE7A Q13946 1/20 0.31
▸ PDE3A Q14432 1/20 0.31
▸ PDE10A Q9Y233 1/20 0.31
▸ LRRK2 Q5S007 1/20 0.30

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
SCHEMBL27118043 1.00 GRM5 (0.36) GRM5PTGS2PTGS1GLAKMT2A
SCHEMBL27118049 0.88 GRM5 (0.35) GRM5PTGS2PTGS1PIK3CDPIK3R2
SCHEMBL27118703 0.87 GRM5 (0.38) GRM5GLAKMT2APIK3CDPIK3R2
SCHEMBL30759592 0.86 GRM5 (0.38) GRM5GLAKMT2APIK3CDPIK3R2
SCHEMBL27119377 0.86 GRM5 (0.38) GRM5GLAKMT2APIK3CDPIK3R2
SCHEMBL27117858 0.85 GRM5 (0.38) GRM5GLAKMT2APIK3CDPIK3R2
SCHEMBL31236983 0.85 GRM5 (0.38) GRM5GLAKMT2APIK3CDPIK3R2
SCHEMBL30759571 0.85 GRM5 (0.38) GRM5GLAKMT2APIK3CDPIK3R2
SCHEMBL30759569 0.85 GRM5 (0.36) GRM5PTGS2
SCHEMBL27118044 0.85 GRM5 (0.36) GRM5PTGS2

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
EP-4577206-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF Celmatix Inc. (US) 2025-07-02 — — EP disclosed
WO-2024044778-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF CELMATIX INC. (US) 2024-02-29 — — WO disclosed
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