SCHEMBL4032049

SCHEMBL4032049

CN1Cc2c(Cl)cc(Cl)cc2C(c2ccc(NC(=O)c3cc[nH]c3)cc2)C1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A3 P48764 11/20 0.51

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
SCHEMBL4026399 0.91 SLC9A3 (0.61) SLC9A3
SCHEMBL4029734 0.88 SLC9A3 (0.51) SLC9A3
SCHEMBL13285852 0.87 SLC9A3 (0.51) SLC9A3
SCHEMBL4025753 0.86 SLC9A3 (0.53) SLC9A3
Hydrochloric Acid SCHEMBL4030085 0.86 SLC9A3 (0.53) SLC9A3
SCHEMBL4025904 0.85 SLC9A3 (0.48) SLC9A3
SCHEMBL13449799 0.85 SLC9A3 (0.53) SLC9A3
SCHEMBL4033472 0.85 SLC9A3 (0.51) SLC9A3
SCHEMBL4033170 0.85 SLC9A3 (0.47) SLC9A3
SCHEMBL4032076 0.85 SLC9A3 (0.49) 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