SCHEMBL4029815

SCHEMBL4029815

CN1Cc2c(Cl)cc(Cl)cc2C(c2ccc(NC(=O)C(N)CCCCN)cc2)C1

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A3 P48764 13/20 0.53

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
SCHEMBL13911160 1.00 SLC9A3 (0.53) SLC9A3
SCHEMBL13911105 0.92 SLC9A3 (0.47) SLC9A3
SCHEMBL4031723 0.91 SLC9A3 (0.66) SLC9A3
SCHEMBL13911142 0.91 SLC9A3 (0.66) SLC9A3
SCHEMBL13911102 0.89 SLC9A3 (0.56) SLC9A3
SCHEMBL4026372 0.89 SLC9A3 (0.56) SLC9A3
SCHEMBL5630367 0.87 SLC9A3 (0.50) SLC9A3
SCHEMBL5629525 0.87 SLC9A3 (0.50) SLC9A3
SCHEMBL4028833 0.86 SLC9A3 (0.56) SLC9A3
SCHEMBL13911109 0.86 SLC9A3 (0.56) SLC9A3

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
EP-1453810-B1 SUBSTITUTED 4-PHENYLTETRAHYDROISOQUINOLINES, METHOD FOR THE PRODUCTION THEREOF, THE USE THEREOF AS MEDICAMENTS, IN ADDITION TO A MEDICAMENT CONTAINING SAME SANOFI AVENTIS DEUTSCHLAND (DE) 2009-03-18 EP claimed
EP-1453810-B1 SUBSTITUTED 4-PHENYLTETRAHYDROISOQUINOLINES, METHOD FOR THE PRODUCTION THEREOF, THE USE THEREOF AS MEDICAMENTS, IN ADDITION TO A MEDICAMENT CONTAINING SAME SANOFI AVENTIS DEUTSCHLAND (DE) 2009-03-18 EP disclosed