SCHEMBL7328459

SCHEMBL7328459

Cc1c(OCCN2CCOCC2)ccc2c(=O)cc(N3CCOCC3)oc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 20/20 1.00

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
SCHEMBL7322274 0.96 P2RY12 (1.00) P2RY12
SCHEMBL8798991 0.95 P2RY12 (1.00) P2RY12
SCHEMBL7317647 0.95 P2RY12 (1.00) P2RY12
SCHEMBL9533901 0.95 P2RY12 (1.00) P2RY12
SCHEMBL8799044 0.94 P2RY12 (0.89) P2RY12
SCHEMBL8800322 0.93 P2RY12 (1.00) P2RY12
SCHEMBL8881557 0.93 P2RY12 (1.00) P2RY12
SCHEMBL8881274 0.93 P2RY12 (1.00) P2RY12
SCHEMBL8881859 0.91 P2RY12 (0.84) P2RY12
SCHEMBL7327989 0.91 P2RY12 (0.92) P2RY12

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 4 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