SCHEMBL22909600

SCHEMBL22909600

CCc1ccc(CSc2c(F)c(F)c(F)c(F)c2SN(C)C)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA13 Q8N1Q1 1/20 0.36
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.32
DAO P14920 1/20 0.31
GPR84 Q9NQS5 1/20 0.31
ALOX15B O15296 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
GAA P10253 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 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
SCHEMBL22909164 0.87 CA12 (0.49) CA12CA1CA2CA7CA13
SCHEMBL22909496 0.79 LMNA (0.33) LMNA
SCHEMBL22909449 0.73 HDAC3 (0.34) LMNAGAA
SCHEMBL22909609 0.69 SIGMAR1 (0.31)
SCHEMBL18257673 0.69 CA12 (0.46) CA12CA1CA2CA7CA13
SCHEMBL17629199 0.66 CA12 (0.66) IDO1CA12CA1CA2CA7
SCHEMBL24282820 0.65 CA12 (0.37) IDO1CA12CA1CA2CA7
SCHEMBL20436774 0.65 CA12 (0.42) CA12CA1CA2CA7CA13
SCHEMBL22909233 0.64 GFER (0.42) CYP3A4
Trimethylammonium SCHEMBL27719445 0.63 TP53 (0.56) IDO1CA2LMNACYP1A2L3MBTL1

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-2021009568-A1 BENZENESULFONAMIDE DERIVATIVES AND USES THEREOF 2692372 ONTARIO, INC. (CA) 2021-01-21 WO disclosed