SCHEMBL20708646

SCHEMBL20708646

Bc1cc(C(F)(F)F)cc2nc(-c3ccccc3SCC)n(C)c12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DDR1 Q08345 1/20 0.34
▸ MET P08581 2/20 0.32
▸ ALOX5AP P20292 1/20 0.32
▸ FEN1 P39748 1/20 0.32
▸ CASR P41180 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ HSD11B1 P28845 4/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ PDE2A O00408 1/20 0.31
▸ PDE10A Q9Y233 1/20 0.31
▸ NR1I2 O75469 1/20 0.31
▸ GSR P00390 1/20 0.30
▸ MAOA P21397 1/20 0.30
▸ MAOB P27338 1/20 0.30
▸ TACR1 P25103 1/20 0.30
▸ SLC6A2 P23975 1/20 0.30
▸ SLC6A4 P31645 1/20 0.30
▸ SLC6A3 Q01959 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
SCHEMBL9958588 0.87 HSD11B1 (0.34) DDR1METALOX5APFEN1CASR
SCHEMBL9953119 0.87 SLC6A2 (0.38) DDR1METALOX5APFEN1CASR
SCHEMBL9958612 0.87 HSD11B1 (0.38) DDR1METCASRHSD11B1PDE2A
SCHEMBL9959582 0.81 AGPAT2 (0.44) DDR1HSD11B1ALDH1A1PDE2APDE10A
SCHEMBL15411967 0.79 POLB (0.49) DDR1METALOX5APFEN1NPC1
SCHEMBL9959573 0.75 KDM4E (0.38) DDR1ALOX5APFEN1NPC1ATM
SCHEMBL15412048 0.74 POLB (0.42) DDR1METALOX5APFEN1POLB
SCHEMBL15426445 0.74 KDM4E (0.38) DDR1ALOX5APFEN1NPC1ATM
SCHEMBL15426346 0.74 HSD11B1 (0.39) ALOX5APFEN1NPC1ATMHSD11B1
SCHEMBL15426458 0.74 NPC1 (0.36) ALOX5APFEN1NPC1ATMHSD11B1

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
EP-3006429-B1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL CO (JP) 2019-02-06 — — EP disclosed
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