SCHEMBL7397298

SCHEMBL7397298

CCCCOC(=O)CC1CCc2ccc(NC(=O)c3ccc(/C=N/N4CCSCC4)cc3)cc2C1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 7/20 0.48
ITGA2B P08514 7/20 0.48
MCHR1 Q99705 10/20 0.40
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL7397300 1.00 ITGB3 (0.48) ITGB3ITGA2BMCHR1MAPTLMNA
SCHEMBL7397660 0.97 ITGB3 (0.46) ITGB3ITGA2BMCHR1MAPTLMNA
SCHEMBL7397658 0.97 ITGB3 (0.46) ITGB3ITGA2BMCHR1MAPTLMNA
SCHEMBL7392548 0.97 ITGB3 (0.44) ITGB3ITGA2BMCHR1
SCHEMBL7392544 0.97 ITGB3 (0.44) ITGB3ITGA2BMCHR1
SCHEMBL7390233 0.93 ITGB3 (0.49) ITGB3ITGA2BMCHR1
SCHEMBL7390232 0.93 ITGB3 (0.49) ITGB3ITGA2BMCHR1
SCHEMBL7395702 0.93 ITGB3 (0.41) ITGB3ITGA2BMCHR1MAPTHPGD
SCHEMBL7395705 0.93 ITGB3 (0.41) ITGB3ITGA2BMCHR1MAPTHPGD
SCHEMBL7393874 0.93 ITGB3 (0.49) ITGB3ITGA2BMCHR1MAPTLMNA

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-0760364-B1 Amidine derivatives and platelet aggregation inhibitor containing the same MITSUI CHEMICALS INC (JP) 2000-07-19 EP disclosed
EP-0760364-A2 Amidine derivatives and platelet aggregation inhibitor containing the same MITSUI TOATSU CHEMICALS, Inc. (JP) 1997-03-05 EP disclosed