SCHEMBL24629973

SCHEMBL24629973

Cc1cc(S(=O)(=O)Cl)c2c(c1)cc(C#N)n2C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
PKM P14618 1/20 0.33
KMT2A Q03164 1/20 0.33
AR P10275 1/20 0.32
TRPV4 Q9HBA0 2/20 0.32

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
SCHEMBL24629466 0.77 ALDH1A1 (0.36) MEN1PKMKMT2A
SCHEMBL24629878 0.74 AR (0.41) MEN1PKMKMT2AAR
SCHEMBL24630010 0.69 PPARG (0.37) MEN1KMT2A
SCHEMBL24629880 0.67 TRPV4 (0.32) TRPV4
SCHEMBL12320911 0.65 AR (0.36) MEN1PKMKMT2AAR
SCHEMBL22579369 0.64 MEN1 (0.43) MEN1PKMKMT2AAR
SCHEMBL7129180 0.64 KDM4E (0.44) MEN1KMT2ATRPV4
SCHEMBL744084 0.64 TRPV4 (0.40) ARTRPV4
SCHEMBL806475 0.64 RXFP1 (0.49) MEN1KMT2AAR
SCHEMBL806481 0.62 AR (0.32) MEN1KMT2AAR

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-2022150574-A1 INHIBITORS OF MYCOBACTERIUM TUBERCULOSIS LIPOAMIDE DEHYDROGENASE CORNELL UNIVERSITY (US) 2022-07-14 WO disclosed