SCHEMBL1743590

SCHEMBL1743590

O=c1c(-c2ccc(Cl)cc2)c[nH]c2ccnc([AsH2])c12.c1ccc2c(c1)CC2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.36
▸ THRB P10828 1/20 0.36
▸ MET P08581 2/20 0.35
▸ KDR P35968 2/20 0.35
▸ ALOX5 P09917 1/20 0.34
▸ EGFR P00533 2/20 0.34
▸ SRC P12931 1/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ HTT P42858 1/20 0.34
▸ AXL P30530 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ LMNA P02545 2/20 0.34
▸ DYRK1A Q13627 1/20 0.34
▸ LRRK2 Q5S007 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ PDE3B Q13370 1/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ MAPKAPK2 P49137 1/20 0.33
▸ ADORA1 P30542 1/20 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
SCHEMBL1743421 0.78 LRRK2 (0.41) MAPTTHRBMETKDRALOX5
SCHEMBL2838272 0.74 MET (0.51) METKDRAXL
SCHEMBL1741332 0.73 KDM4E (0.48) METKDREGFRSRCAXL
SCHEMBL15084547 0.72 PARP1 (0.42) MAPTMETKDREGFRSRC
SCHEMBL1741301 0.72 MET (0.45) METKDREGFRAXLSMN1; SMN2
SCHEMBL1742647 0.71 MET (0.55) METKDRAXL
SCHEMBL1741948 0.71 UTS2R (0.43) METKDRAXLLRRK2
SCHEMBL1741949 0.71 UTS2R (0.47) MAPTTHRBMETKDREGFR
SCHEMBL1743429 0.70 ALOX5 (0.35) MAPTTHRBMETKDRALOX5
SCHEMBL1743562 0.70 MET (0.45) METKDRAXLALDH1A1LMNA

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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