SCHEMBL31160541

SCHEMBL31160541

C=Cc1cc(-c2ccc(F)cc2F)cc2c1CNC2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 1/20 0.44
▸ PIK3CD O00329 3/20 0.44
▸ PIK3CB P42338 3/20 0.44
▸ TDP2 O95551 1/20 0.40
▸ PIK3CA P42336 2/20 0.40
▸ GRM5 P41594 3/20 0.36
▸ FLT3 P36888 2/20 0.36
▸ DAPK3 O43293 1/20 0.36
▸ NTRK1 P04629 1/20 0.36
▸ PIM1 P11309 1/20 0.36
▸ GSK3B P49841 1/20 0.36
▸ ROCK1 Q13464 1/20 0.36
▸ CLK4 Q9HAZ1 1/20 0.36
▸ PIK3CG P48736 2/20 0.36
▸ PARP10 Q53GL7 2/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ KDR P35968 2/20 0.34
▸ PDE3B Q13370 1/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ MAPK14 Q16539 1/20 0.33

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
SCHEMBL31160535 0.88 GRM2 (0.45) GRM2PIK3CDPIK3CBTDP2PIK3CA
SCHEMBL31160527 0.80 GRM2 (0.47) GRM2PIK3CDPIK3CBTDP2PIK3CA
SCHEMBL31160524 0.75 PIK3CD (0.45) GRM2PIK3CDPIK3CBTDP2PIK3CA
SCHEMBL31160512 0.73 PDE3B (0.48) GRM2PIK3CDPIK3CBTDP2PIK3CA
SCHEMBL31160519 0.73 PIK3CD (0.46) GRM2PIK3CDPIK3CBTDP2PIK3CA
SCHEMBL30915406 0.72 TDP2 (0.59) GRM2TDP2GRM5FLT3DAPK3
SCHEMBL31160522 0.72 PDE3B (0.46) GRM2PIK3CDPIK3CBTDP2PIK3CA
SCHEMBL31160529 0.72 PIK3CD (0.42) GRM2PIK3CDPIK3CBTDP2PIK3CA
SCHEMBL31160534 0.72 MAPK14 (0.46) GRM2PIK3CDPIK3CBTDP2MAPK14
SCHEMBL31160516 0.71 GRM2 (0.44) GRM2PIK3CDPIK3CBTDP2PIK3CA

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-4673136-A1 NEGATIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 Vanderbilt University (US) 2026-01-07 — — EP disclosed
WO-2024182692-A1 NEGATIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 VANDERBILT UNIVERSITY (US) 2024-09-06 — — WO disclosed
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