SCHEMBL15529237

SCHEMBL15529237

CCCNc1nccc(-c2ccc(OCC)cc2)c1C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.48
▸ HPGD P15428 3/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ CHRNA7 P36544 6/20 0.47
▸ PARP10 Q53GL7 1/20 0.43
▸ MAPT P10636 3/20 0.43
▸ GAA P10253 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ SRC P12931 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ AHR P35869 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ KDM5A P29375 1/20 0.38
▸ KDM2B Q8NHM5 1/20 0.38
▸ KDM4C Q9H3R0 1/20 0.38

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
SCHEMBL15529231 0.87 MAPT (0.50) ALDH1A1HPGDKDM4ECHRNA7MAPT
SCHEMBL15529333 0.71 KDM4E (0.49) ALDH1A1HPGDKDM4EMAPTGAA
SCHEMBL1741974 0.70 MET (0.46) MAPTLMNA
SCHEMBL15529130 0.70 KDM4E (0.48) ALDH1A1HPGDKDM4EMAPTLMNA
SCHEMBL1741145 0.70 MAPT (0.46) ALDH1A1KDM4ECHRNA7MAPTLMNA
SCHEMBL4966792 0.68 BCAT2 (0.59) ALDH1A1HPGDHSD17B10KDM4EPARP10
SCHEMBL1758347 0.68 PARP10 (0.59) ALDH1A1HPGDKDM4EPARP10MAPT
SCHEMBL9591177 0.68 ALDH1A1 (0.46) ALDH1A1HPGDHSD17B10KDM4EMAPT
SCHEMBL27927983 0.68 KDM4E (0.49) ALDH1A1HPGDHSD17B10KDM4EKCNH2
SCHEMBL15529202 0.67 KDM4E (0.65) ALDH1A1HPGDHSD17B10KDM4EMAPT

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-2846803-A1 ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ALLOSTERIC MODULATORS, THEIR DERIVATIVES AND USES THEREOF Anvyl, LLC (US) 2015-03-18 — — EP disclosed
WO-2013169889-A1 ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ALLOSTERIC MODULATORS, THEIR DERIVATIVES AND USES THEREOF ANVYL LLC (US) 2013-11-14 — — WO disclosed
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