SCHEMBL7394346

SCHEMBL7394346

CCOC(=O)CC1CCc2cc(NC(=O)c3ccc(C=NN4CCCCC4)cc3)ccc2C1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 6/20 0.49
ITGA2B P08514 6/20 0.49
MCHR1 Q99705 13/20 0.47
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL7391506 1.00 ITGB3 (0.49) ITGB3ITGA2BMCHR1NPC1LMNA
SCHEMBL7394345 1.00 ITGB3 (0.49) ITGB3ITGA2BMCHR1NPC1LMNA
SCHEMBL7386957 0.99 ITGB3 (0.49) ITGB3ITGA2BMCHR1NPC1LMNA
SCHEMBL7386955 0.99 ITGB3 (0.49) ITGB3ITGA2BMCHR1NPC1LMNA
SCHEMBL7398208 0.97 ITGB3 (0.50) ITGB3ITGA2BMCHR1NPC1LMNA
SCHEMBL7395363 0.97 ITGB3 (0.50) ITGB3ITGA2BMCHR1NPC1LMNA
SCHEMBL7398205 0.97 ITGB3 (0.50) ITGB3ITGA2BMCHR1NPC1LMNA
Hydrochloric Acid SCHEMBL7394077 0.96 ITGB3 (0.49) ITGB3ITGA2BMCHR1NPC1LMNA
SCHEMBL7395356 0.96 ITGB3 (0.51) ITGB3ITGA2BMCHR1NPC1LMNA
SCHEMBL7395353 0.96 ITGB3 (0.51) ITGB3ITGA2BMCHR1NPC1LMNA

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