SCHEMBL7306751

SCHEMBL7306751

CCC1c2cc(N(C)Cc3ccc(C(=N)N)cc3)ccc2CCC1CC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
ITGB3 P05106 14/20 0.42
ITGA2B P08514 14/20 0.42
F2 P00734 3/20 0.34

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
SCHEMBL7302144 0.85 ITGB3 (0.49) ITGB3ITGA2B
SCHEMBL7307229 0.79 ITGB3 (0.60) RXRARXRBRXRGITGB3ITGA2B
SCHEMBL7300114 0.78 ITGB3 (0.47) ITGB3ITGA2B
SCHEMBL7303281 0.74 PGR (0.40)
SCHEMBL7300393 0.73 AKR1C4 (0.42)
SCHEMBL7304733 0.72 ACHE (0.37)
Hydrochloric Acid SCHEMBL7302244 0.72 AKR1C4 (0.41)
SCHEMBL7298694 0.70 ITGB3 (0.47) ITGB3ITGA2B
SCHEMBL7306389 0.70 MEN1 (0.35) ITGB3ITGA2B
SCHEMBL7301241 0.68 MEN1 (0.37) ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0709370-B1 Bicyclic compounds useful as platelet aggregation inhibitors MITSUI CHEMICALS INC (JP) 1999-01-13 EP disclosed
US-5629321-A FIBRINOGEN ANTAGONIST MITSUI TOATSU CHEMICALS, INC. (JP) 1997-05-13 US disclosed
EP-0709370-A1 Bicyclic compounds useful as platelet aggregation inhibitors MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-05-01 EP disclosed