SCHEMBL7385244

SCHEMBL7385244

Cc1nn(-c2ccc(C(=N)N)cc2)c(=O)n1-c1cccc(CCC(=O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 13/20 0.49
ITGB3 P05106 5/20 0.48
ITGA2B P08514 5/20 0.48
PLA2G2A P14555 5/20 0.43
PLA2G5 P39877 1/20 0.40
F10 P00742 2/20 0.39
F2 P00734 1/20 0.39

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
SCHEMBL7273965 0.89 ITGB3 (0.57) ITGB3ITGA2BF10F2
SCHEMBL7282152 0.89 ITGB3 (0.57) ITGB3ITGA2BF10F2
SCHEMBL7281388 0.78 ITGB3 (0.43) ITGB3ITGA2BF10F2
SCHEMBL7272941 0.78 ITGB3 (0.54) ITGB3ITGA2BF10F2
SCHEMBL7282038 0.77 RXRA (0.45) PLA2G10ITGB3ITGA2B
Hydrochloric Acid SCHEMBL7387376 0.77 F2 (0.46) ITGB3ITGA2BF10F2
Hydrochloric Acid SCHEMBL7283561 0.77 ITGB3 (0.42) ITGB3ITGA2BF10F2
Hydrochloric Acid SCHEMBL7273430 0.77 ITGB3 (0.42) ITGB3ITGA2BF10F2
SCHEMBL7280759 0.76 ITGB3 (0.55) ITGB3ITGA2BF10F2
SCHEMBL7390265 0.76 PRSS1 (0.45) 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
US-5880284-A HAVING ANTITHROMBOTIC, ANTIAGGREGATORY AND TUMOR- OR METASTASES-INHIBITING EFFECTS DR. KARL THOMAE GMBH (DE) 1999-03-09 US disclosed
US-5681841-A PREVENTION CELL AGGREGATION KARL THOMAE GMBH (DE) 1997-10-28 US disclosed
EP-0587134-A2 Cyclic urea derivatives, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1994-03-16 EP disclosed