SCHEMBL2232157

SCHEMBL2232157

Cc1cc(CNC(=O)c2ccc3cccnc3c2O)no1.Cc1csc(CNC(=O)c2ccc3cccnc3c2O)n1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 14/20 0.51
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
NAMPT P43490 1/20 0.42
GRK6 P43250 1/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL2199705 0.91 EGLN1 (0.61) EGLN1NPC1RAB9AGRK6ALDH1A1
SCHEMBL2201303 0.89 EGLN1 (0.62) EGLN1NAMPTALDH1A1
SCHEMBL2202067 0.76 EGLN1 (0.63) EGLN1ALDH1A1
SCHEMBL2202613 0.75 EGLN1 (0.65) EGLN1ALDH1A1
SCHEMBL15327083 0.74 RAB9A (0.46) NPC1RAB9AALDH1A1
SCHEMBL15327091 0.74 NAMPT (0.46) EGLN1NPC1RAB9ANAMPTALDH1A1
SCHEMBL2203862 0.72 EGLN1 (0.74) EGLN1NPC1RAB9AALDH1A1
SCHEMBL2201945 0.72 EGLN1 (0.66) EGLN1ALDH1A1
SCHEMBL7685030 0.70 EGLN1 (0.74) EGLN1ALDH1A1
SCHEMBL7691436 0.69 EGLN1 (0.70) EGLN1ALDH1A1

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-2519503-A1 SECONDARY 8-HYDROXYQUINOLINE-7-CARBOXAMIDE DERIVATIVES FOR USE AS ANTIFUNGAL AGENTS POLICHEM S.A. (LU) 2012-11-07 EP claimed
WO-2011080265-A1 SECONDARY 8-HYDROXYQUINOLINE-7-CARBOXAMIDE DERIVATIVES FOR USE AS ANTIFUNGAL AGENTS POLICHEM S.A. (LU) 2011-07-07 WO claimed