SCHEMBL19682780

SCHEMBL19682780

CC1(OC(=O)C(F)(F)F)CCOc2c(S(=O)(=O)Cl)ccc(Cl)c21

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 15/20 0.41
CHRM1 P11229 15/20 0.41
RRM1 P23921 12/20 0.41
RRM2B Q7LG56 12/20 0.41

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
SCHEMBL19682935 0.86 CHRM2 (0.49) CHRM2CHRM1RRM1RRM2B
SCHEMBL21957680 0.79 CHRM2 (0.43) CHRM2CHRM1RRM1RRM2B
SCHEMBL20872788 0.78 CHRM2 (0.51) CHRM2CHRM1RRM1RRM2B
SCHEMBL19682933 0.78 CHRM2 (0.40) CHRM2CHRM1RRM1RRM2B
SCHEMBL19682931 0.76 CHRM2 (0.46) CHRM2CHRM1RRM1RRM2B
SCHEMBL19682334 0.73 CHRM2 (0.42) CHRM2CHRM1RRM1RRM2B
SCHEMBL22492162 0.68 AKR1B1 (0.37)
SCHEMBL21957671 0.66 CHRM2 (0.49) CHRM2CHRM1RRM1RRM2B
SCHEMBL22492165 0.65 CHRM2 (0.44) CHRM2CHRM1RRM1RRM2B
SCHEMBL20872934 0.62 CHRM2 (0.32) CHRM2CHRM1RRM1RRM2B

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-2017209155-A1 SULFONAMIDE COMPOUND OR SALT THEREOF 大鵬薬品工業株式会社 2017-12-07 WO disclosed