SCHEMBL1743587

SCHEMBL1743587

O=c1c(-c2ccc(Cl)cc2)c[nH]c2ccnc([AsH]CCc3ccccc3)c12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ TKT P29401 1/20 0.34
▸ MET P08581 2/20 0.34
▸ KDR P35968 2/20 0.34
▸ AXL P30530 1/20 0.34
▸ HAT1 O14929 2/20 0.33
▸ EP300 Q09472 2/20 0.33
▸ MDM4 O15151 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ MDM2 Q00987 1/20 0.32
▸ BRS3 P32247 1/20 0.32
▸ EGFR P00533 1/20 0.32
▸ SRC P12931 1/20 0.32
▸ CCNA2 P20248 1/20 0.32
▸ CDK2 P24941 1/20 0.32
▸ ALOX5 P09917 1/20 0.32
▸ PRKAB2 O43741 2/20 0.32
▸ PRKAG1 P54619 2/20 0.32
▸ PRKAA2 P54646 2/20 0.32

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
SCHEMBL1741953 0.79 UTS2R (0.49) MAPTTHRBMETKDRAXL
SCHEMBL1741949 0.77 UTS2R (0.47) MAPTTHRBMETKDRAXL
SCHEMBL1743591 0.76 MET (0.35) MAPTTHRBMETKDRAXL
SCHEMBL1743421 0.74 LRRK2 (0.41) MAPTTHRBMETKDRAXL
SCHEMBL2838272 0.73 MET (0.51) METKDRAXL
SCHEMBL15084547 0.72 PARP1 (0.42) MAPTMETKDRAXLEGFR
SCHEMBL1741332 0.70 KDM4E (0.48) METKDRAXLEGFRSRC
SCHEMBL1741956 0.70 MET (0.45) MAPTMETKDRAXLTP53
SCHEMBL1743590 0.70 MAPT (0.36) MAPTTHRBMETKDRAXL
SCHEMBL1743562 0.69 MET (0.45) METKDRAXLLRRK2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2387575-A1 ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTOR ALLOSTERIC MODULATORS, THEIR DERIVATIVES AND USES THEREOF Anvyl, LLC (US) 2011-11-23 — — EP disclosed
US-D647030-S1 Automobile tire tread THE YOKOHAMA RUBBER CO., LTD (JP) 2011-10-18 — — US disclosed
WO-2010083444-A1 ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTOR ALLOSTERIC MODULATORS, THEIR DERIVATIVES AND USES THEREOF ANVYL, LLC (US) 2010-07-22 — — WO disclosed
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