SCHEMBL9952060

SCHEMBL9952060

CCSc1cccc(-c2cccc(F)c2)c1-c1nccn1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTR2C P28335 2/20 0.38
QPCT Q16769 2/20 0.36
HTR2A P28223 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
POLB P06746 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TGFBR1 P36897 1/20 0.35
KDR P35968 1/20 0.34
FFAR1 O14842 2/20 0.33
PRKDC P78527 1/20 0.33
CYP11B1 P15538 1/20 0.33

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
SCHEMBL9953584 0.79 BRD4 (0.40) ALDH1A1HTR2CQPCTMEN1KMT2A
SCHEMBL9952864 0.76 HTR2C (0.37) ALDH1A1KDM4ELMNAMAPTHSD17B10
SCHEMBL12320076 0.76 KDR (0.47) ALDH1A1KDM4EHSD17B10MEN1KMT2A
SCHEMBL9951932 0.75 ALDH1A1 (0.38) ALDH1A1KDM4EMAPTHPGDHSD17B10
SCHEMBL9953820 0.75 HTR2C (0.36) ALDH1A1KDM4EMAPTHSD17B10L3MBTL1
SCHEMBL9952001 0.75 HTR2C (0.36) ALDH1A1KDM4EMAPTHSD17B10L3MBTL1
SCHEMBL9952807 0.75 HTR2C (0.34) ALDH1A1KDM4EMAPTHTR2CHTR2A
SCHEMBL9952034 0.75 BRD4 (0.47) ALDH1A1KDM4ELMNAHSD17B10L3MBTL1
SCHEMBL9952063 0.74 FEN1 (0.39) LMNAHTR2CHTR2AALOX5APFEN1
SCHEMBL9952318 0.73 ALDH1A1 (0.35) ALDH1A1KDM4ELMNAMAPTALOX15

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-2655337-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF Sumitomo Chemical Company Limited (JP) 2013-10-30 EP disclosed
WO-2012086848-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-06-28 WO disclosed