SCHEMBL7876014

SCHEMBL7876014

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

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 1/20 0.52
TPSD1 Q9BZJ3 1/20 0.52
TPSG1 Q9NRR2 1/20 0.52
CPN1 P15169 1/20 0.51
CPB2 Q96IY4 1/20 0.51
ITGB3 P05106 15/20 0.49
ITGA2B P08514 15/20 0.49

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
Hydrochloric Acid SCHEMBL11076520 0.98 TPSAB1 (0.51) TPSAB1TPSD1TPSG1CPN1CPB2
SCHEMBL23586763 0.89 CPN1 (0.45) TPSAB1TPSD1TPSG1CPN1CPB2
SCHEMBL6179700 0.84 ITGB3 (0.45) ITGB3ITGA2B
SCHEMBL14366337 0.82 CPN1 (0.51) CPN1CPB2ITGB3ITGA2B
SCHEMBL6222860 0.81 TPSAB1 (0.55) TPSAB1TPSD1TPSG1CPN1CPB2
Hydrochloric Acid SCHEMBL11079847 0.80 TPSAB1 (0.53) TPSAB1TPSD1TPSG1CPN1CPB2
SCHEMBL17234284 0.80 CPN1 (0.39) TPSAB1TPSD1TPSG1CPN1CPB2
SCHEMBL3833697 0.79 SLC6A1 (0.42) ITGB3ITGA2B
SCHEMBL8830339 0.78 TPSAB1 (0.45) TPSAB1TPSD1TPSG1CPN1CPB2
SCHEMBL4070279 0.78 GAA (0.57)

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
JP-57193456-A None JP disclosed
US-6306848-B1 SKIN TREATMENT KAO CORPORATION (JP) 2001-10-23 US disclosed
US-4433152-A ANTIINFLAMMATORY AGENT, ANTIALLERGEN OR ANTICOAGULANT NIPPON CHEMIPHAR CO., LTD. (JP) 1984-02-21 US disclosed
JP-S57193456-A NOVEL AMIDINOPIPERIDINE DERIVATIVE AND ITS PREPARATION NIPPON CHEMIPHAR CO LTD 1982-11-27 JP disclosed