SCHEMBL29920701

SCHEMBL29920701

CC(C)(C)OC(=O)NS(=O)(=O)CC1(O)CC2(CCC2)Oc2cc(F)ccc21

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
AKR1B1 P15121 2/20 0.35
RORC P51449 14/20 0.34
TRPV1 Q8NER1 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33

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
SCHEMBL29920339 1.00 CA12 (0.35) CA12CA1CA7CA14AKR1B1
SCHEMBL29920828 0.96 CA12 (0.36) CA12CA1CA7CA14AKR1B1
SCHEMBL29920997 0.96 CA12 (0.36) CA12CA1CA7CA14AKR1B1
SCHEMBL29920356 0.88 AKR1B1 (0.46) CA12CA1CA7CA14AKR1B1
SCHEMBL29920439 0.78 AKR1B1 (0.48) AKR1B1RORC
SCHEMBL29920830 0.76 AKR1B1 (0.43) CA12CA1CA7CA14AKR1B1
SCHEMBL29920666 0.74 RORC (0.35) CA12CA1CA7CA14RORC
SCHEMBL29920644 0.74 RORC (0.35) CA12CA1CA7CA14RORC
SCHEMBL29920385 0.72 MAP3K14 (0.39) CA12CA1CA7CA14AKR1B1
SCHEMBL29920603 0.71 MAP3K14 (0.38) CA12CA1CA7CA14AKR1B1

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-2022217248-A1 SUBSTITUTED SULFONAMIDE-CHROMAN COMPOUNDS, AND PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2022-10-13 WO disclosed