SCHEMBL7398264

SCHEMBL7398264

Cc1nn(-c2ccc(C(=N)N)cc2)c(=O)n1[C@H]1CC[C@H](CCC(=O)O)CC1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 18/20 0.40
ITGA2B P08514 18/20 0.40
ALOX15 P16050 1/20 0.38
DGAT1 O75907 1/20 0.36

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
SCHEMBL7392883 1.00 ITGB3 (0.40) ITGB3ITGA2BALOX15DGAT1
SCHEMBL7392878 1.00 ITGB3 (0.40) ITGB3ITGA2BALOX15DGAT1
SCHEMBL7393184 0.89 ITGB3 (0.40) ITGB3ITGA2B
SCHEMBL7393187 0.89 ITGB3 (0.40) ITGB3ITGA2B
SCHEMBL7393216 0.89 ITGB3 (0.40) ITGB3ITGA2B
Hydrochloric Acid SCHEMBL7392608 0.86 ITGB3 (0.36) ITGB3ITGA2BALOX15
Hydrochloric Acid SCHEMBL7394989 0.86 ITGB3 (0.36) ITGB3ITGA2BALOX15
SCHEMBL7389347 0.79 ITGB3 (0.41) ITGB3ITGA2BALOX15
SCHEMBL7389350 0.79 ITGB3 (0.41) ITGB3ITGA2BALOX15
SCHEMBL8566938 0.79 PPARD (0.33) DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0587134-A2 Cyclic urea derivatives, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1994-03-16 EP claimed
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