SCHEMBL16614155

SCHEMBL16614155

c1ccc(-c2ccc(C3(c4ccc(N(c5ccccc5)c5ccc(-c6ccc7ccccc7c6)cc5)cc4)c4ccccc4-c4c3ccc3c4oc4ccccc43)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.32
▸ NPC1 O15118 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ RAB9A P51151 1/20 0.30

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
SCHEMBL19169996 0.98 ALOX5 (0.32) ALOX5NPC1CYP1A2CYP2C9CYP2C19
SCHEMBL16614166 0.95 ALOX5 (0.33) ALOX5
SCHEMBL16614143 0.95 ALOX5 (0.30) ALOX5
SCHEMBL19176799 0.94 ALOX5 (0.33) ALOX5
SCHEMBL18969111 0.94 ALOX5 (0.33) ALOX5
SCHEMBL19170165 0.91 ALOX5 (0.34) ALOX5
SCHEMBL16614168 0.91 ALOX5 (0.34) ALOX5
SCHEMBL16614144 0.91 ALOX5 (0.35) ALOX5
SCHEMBL24406513 0.91 NPC1 (0.32) ALOX5NPC1CYP1A2CYP2C9CYP2C19
SCHEMBL16614127 0.91 ALOX5 (0.31) ALOX5

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015046955-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2015-04-02 — — WO disclosed
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