SCHEMBL14366337

SCHEMBL14366337

CC(=N)N1CCC(CC(=O)O)CC1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 1/20 0.51
CPB2 Q96IY4 1/20 0.51
ITGB3 P05106 16/20 0.47
ITGA2B P08514 16/20 0.47

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
SCHEMBL2422675 0.86 EPHX2 (0.42) ITGB3ITGA2B
SCHEMBL7876014 0.82 TPSAB1 (0.52) CPN1CPB2ITGB3ITGA2B
SCHEMBL20003158 0.82 ITGB3 (0.40) ITGB3ITGA2B
SCHEMBL3833697 0.81 SLC6A1 (0.42) ITGB3ITGA2B
Hydrochloric Acid SCHEMBL11076520 0.81 TPSAB1 (0.51) CPN1CPB2ITGB3ITGA2B
SCHEMBL14610967 0.79 ITGB3 (0.60) ITGB3ITGA2B
SCHEMBL16887542 0.78 ALDH1A1 (0.39) ITGB3ITGA2B
SCHEMBL1787747 0.78 EPHX2 (0.47) ITGB3ITGA2B
SCHEMBL28955984 0.78 ALDH1A1 (0.39) ITGB3ITGA2B
SCHEMBL6179700 0.78 ITGB3 (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018128828-A1 NOVEL HEPCIDIN MIMETICS AND USES THEREOF BAYER HEALTHCARE LLC (US) 2018-07-12 WO disclosed
US-7312235-B2 Benzamide inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-12-25 US disclosed