SCHEMBL19634192

SCHEMBL19634192

COc1ccc(CN(Sc2cc(Br)c(F)cc2F)c2cscn2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APLNR P35414 4/20 0.34
QPCT Q16769 1/20 0.31
LMNA P02545 2/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CHRM2 P08172 1/20 0.30
CYP3A4 P08684 1/20 0.30
HTR1A P08908 1/20 0.30
ADRA2A P08913 1/20 0.30
CYP2D6 P10635 1/20 0.30
TSHR P16473 1/20 0.30
DRD1 P21728 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
SLC6A4 P31645 1/20 0.30
CYP2C19 P33261 1/20 0.30
HRH1 P35367 1/20 0.30
OPRM1 P35372 1/20 0.30
HTR2B P41595 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
SCHEMBL19634264 0.91 GCK (0.33) APLNRMEN1ALDH1A1KMT2A
SCHEMBL19634304 0.88 ACLY (0.35) APLNRQPCTLMNAMEN1ALDH1A1
SCHEMBL19634076 0.85 APLNR (0.32) APLNRQPCTLMNAALDH1A1
SCHEMBL21783460 0.76 ALDH1A1 (0.34) APLNRLMNAMEN1ALDH1A1CYP1A2
SCHEMBL19613710 0.76 ACLY (0.38) APLNRLMNAALDH1A1
SCHEMBL21794068 0.76 APLNR (0.34) APLNRLMNAMEN1ALDH1A1CYP1A2
SCHEMBL19634133 0.75 HTR2A (0.38) APLNRLMNAMEN1ALDH1A1CYP1A2
SCHEMBL21794109 0.74 ALDH1A1 (0.34) APLNRLMNAMEN1ALDH1A1CYP1A2
SCHEMBL19634161 0.74 ALDH1A1 (0.34) APLNRQPCTLMNAMEN1ALDH1A1
SCHEMBL21793990 0.71 ACLY (0.35) LMNAMEN1ALDH1A1KMT2A

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
WO-2017201468-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2017-11-23 WO disclosed