SCHEMBL11684222

SCHEMBL11684222

Cc1ccc(S(=O)(=O)O)cc1NS(=O)(=O)c1ccc(N)c(C(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 11/20 0.54
FFAR1 O14842 3/20 0.49
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CCR2 P41597 2/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL11684501 0.90 FFAR4 (0.54) FFAR4FFAR1MEN1KMT2ACCR2
SCHEMBL11686358 0.85 FFAR4 (0.54) FFAR4FFAR1MEN1KMT2A
SCHEMBL11243895 0.81 FFAR4 (0.54) FFAR4FFAR1MEN1KMT2AMAPT
SCHEMBL11679952 0.81 ALDH1A1 (0.47) MEN1KMT2AMAPTTSHRCYP2C9
SCHEMBL11682704 0.81 FFAR4 (0.67) FFAR4FFAR1MEN1KMT2AMAPT
Methane SCHEMBL11684647 0.80 FFAR4 (0.66) FFAR4FFAR1MEN1KMT2AMAPT
SCHEMBL11518943 0.79 FFAR4 (0.64) FFAR4FFAR1MEN1KMT2ATSHR
Methane SCHEMBL11683666 0.78 FFAR4 (0.63) FFAR4FFAR1TSHR
SCHEMBL776654 0.75 TAS2R14 (0.39) FFAR4MAPTTSHR
SCHEMBL11683401 0.74 ALDH1A1 (0.48) MEN1KMT2AMAPTTSHRCYP2C9

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
US-4055557-A MONOAZO DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-10-25 US disclosed