SCHEMBL16235225

SCHEMBL16235225

COc1cc(SC)nnc1N(c1ccc(F)c(F)c1)S(C)(=O)=O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ PTGS2 P35354 2/20 0.30
▸ SLC6A4 P31645 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
SCHEMBL16235020 0.83 KMT2A (0.34) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL16235562 0.83 MEN1 (0.34) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL16235078 0.74 POLB (0.34) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL16235054 0.70 HTT (0.31) MAPTHTT
SCHEMBL16235789 0.66 ALDH1A1 (0.33) ALDH1A1LMNAMAPTHTT
SCHEMBL16235685 0.66 SMN1; SMN2 (0.49) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL16235221 0.66 CYP17A1 (0.36) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL16234970 0.62 ALDH1A1 (0.31) KMT2AMEN1ALDH1A1MAPT
SCHEMBL16235348 0.59 CCR4 (0.35) —
SCHEMBL29131000 0.58 MAPT (0.36) KMT2AMEN1ALDH1A1LMNAMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2925743-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS Active Biotech AB (SE) 2015-10-07 — — EP disclosed
WO-2014184234-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS ACTIVE BIOTECH AB (SE) 2014-11-20 — — WO disclosed
Send feedback