SCHEMBL8407362

SCHEMBL8407362

Cc1ccc(-c2ccc(C(=O)N3CCC(CC(=O)O)CC3)cc2C(=N)N)cc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.48
ITGB3 P05106 16/20 0.48
ITGA2B P08514 16/20 0.48
CYP46A1 Q9Y6A2 1/20 0.45

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
SCHEMBL8863340 0.79 ITGB3 (0.61) ITGB3ITGA2B
Hydrochloric Acid SCHEMBL8410466 0.78 ITGB3 (0.60) ITGB3ITGA2B
SCHEMBL8949202 0.75 ITGB3 (0.49) ITGB3ITGA2B
SCHEMBL8949010 0.74 ITGB3 (0.50) ITGB3ITGA2B
SCHEMBL8949136 0.73 ITGB3 (0.54) ITGB3ITGA2B
SCHEMBL8949182 0.73 ITGB3 (0.52) ITGB3ITGA2B
SCHEMBL8410417 0.72 ITGB3 (0.56) ITGB3ITGA2B
SCHEMBL8407358 0.71 SMN1; SMN2 (0.54) ITGB3ITGA2B
SCHEMBL8949282 0.71 ITGB3 (0.49) ITGB3ITGA2B
SCHEMBL24492532 0.70 ALDH1A1 (0.46) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5922763-A ANTICOAGULANT; CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1999-07-13 US disclosed
US-5736559-A CARDIOVASCULAR DISORDERS; RESPIRATORY SYSTEM DISORDERS KARL THOMAE GMBH (DE) 1998-04-07 US disclosed
US-5597825-A AGGREGATION INHIBITORS DR. KARL THOMAE GMBH (DE) 1997-01-28 US disclosed
EP-0496378-B1 Biphenylderivatives, drugs containing these compounds and processes for their preparation THOMAE GMBH DR K (DE) 1995-09-20 EP disclosed
EP-0496378-A1 Biphenylderivatives, drugs containing these compounds and processes for their preparation Dr. Karl Thomae GmbH (DE) 1992-07-29 EP disclosed