SCHEMBL7324324

SCHEMBL7324324

Cc1c(OCc2cccnc2)ccc2c(=O)cc(N3CCOCC3)oc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 19/20 1.00
PIK3CD O00329 1/20 0.71
PIK3CA P42336 1/20 0.71
PIK3CB P42338 1/20 0.71
PIK3CG P48736 1/20 0.71
PRKDC P78527 1/20 0.71

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
SCHEMBL7320166 0.92 P2RY12 (0.84) P2RY12PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL7351469 0.89 P2RY12 (0.80) P2RY12PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL7360857 0.89 P2RY12 (0.80) P2RY12PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL7361296 0.89 P2RY12 (0.81) P2RY12PRKDC
SCHEMBL7326740 0.88 P2RY12 (1.00) P2RY12PRKDC
SCHEMBL30313648 0.88 P2RY12 (0.78) P2RY12PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6362810 0.88 P2RY12 (0.78) P2RY12PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL8799432 0.86 P2RY12 (0.76) P2RY12
SCHEMBL7319977 0.85 P2RY12 (0.75) P2RY12PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL7316746 0.84 P2RY12 (0.85) P2RY12PRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5703075-A Antiatherosclerotic and antithrombotic 1-benzopyran-4-ones and 2-amino-1,3-benzoxazine-4-ones PHARMACIA & UPJOHN COMPANY (US) 1997-12-30 US claimed
EP-0459983-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES PHARMACIA & UPJOHN COMPANY (US) 1991-12-11 EP claimed
WO-1990006921-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES THE UPJOHN COMPANY (US) 1990-06-28 WO claimed
US-5703075-A Antiatherosclerotic and antithrombotic 1-benzopyran-4-ones and 2-amino-1,3-benzoxazine-4-ones PHARMACIA & UPJOHN COMPANY (US) 1997-12-30 US disclosed
WO-1991019707-A2 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES THE UPJOHN COMPANY (US) 1991-12-26 WO disclosed
EP-0459983-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES PHARMACIA & UPJOHN COMPANY (US) 1991-12-11 EP disclosed
WO-1990006921-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES THE UPJOHN COMPANY (US) 1990-06-28 WO disclosed