SCHEMBL5751608

SCHEMBL5751608

CN1Cc2c(Cl)cc(Cl)cc2C(c2cccc(C([NH])=O)c2)C1

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A3 P48764 15/20 0.64

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
SCHEMBL19593798 0.90 SLC9A3 (0.65) SLC9A3
SCHEMBL4029207 0.90 SLC9A3 (0.65) SLC9A3
SCHEMBL4025620 0.89 SLC9A3 (0.67) SLC9A3
SCHEMBL13467104 0.87 SLC9A3 (0.61) SLC9A3
SCHEMBL13449759 0.87 SLC9A3 (0.61) SLC9A3
SCHEMBL13449761 0.87 SLC9A3 (0.61) SLC9A3
SCHEMBL18902843 0.85 SLC9A3 (0.59) SLC9A3
SCHEMBL4034180 0.84 SLC9A3 (0.58) SLC9A3
SCHEMBL5754064 0.84 SLC9A3 (0.67) SLC9A3
SCHEMBL31314205 0.83 SLC9A3 (0.71) 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-1613600-A1 SUBSTITUTED 4-PHENYLTETRAHYDROISOQUINOLINES, METHOD FOR THE PRODUCTION THEREOF, THE USE OF THE SAME AS MEDICAMENTS, AND MEDICAMENT CONTAINING SUCH COMPOUNDS Sanofi-Aventis Deutschland GmbH (DE) 2006-01-11 EP disclosed
WO-2004085404-A1 SUBSTITUTED 4-PHENYLTETRAHYDROISOQUINOLINES, METHOD FOR THE PRODUCTION THEREOF, THE USE OF THE SAME AS MEDICAMENTS, AND MEDICAMENT CONTAINING SUCH COMPOUNDS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2004-10-07 WO disclosed