SCHEMBL16235350

SCHEMBL16235350

COc1nc(SC)cnc1CNS(=O)(=O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CCR4 P51679 3/20 0.46
▸ PDCD1 Q15116 3/20 0.38
▸ CD274 Q9NZQ7 3/20 0.38
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ S100A9 P06702 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ FABP4 P15090 2/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 2/20 0.33
▸ ACLY P53396 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
SCHEMBL16235792 0.83 CCR4 (0.49) CCR4PDCD1CD274MAPK1S100A9
SCHEMBL16235505 0.80 CCR4 (0.70) CCR4S100A9ACLY
SCHEMBL16235231 0.77 RAB9A (0.40) CCR4MEN1KMT2AALDH1A1MAPK1
SCHEMBL16235390 0.73 GAA (0.41) CCR4MAPK1S100A9GAARAB9A
SCHEMBL16235141 0.73 CCR4 (0.50) CCR4PDCD1CD274MEN1KMT2A
SCHEMBL16235235 0.72 TP53 (0.41) CCR4MEN1KMT2AALDH1A1MAPK1
SCHEMBL16234928 0.72 LMNA (0.39) CCR4KMT2AALDH1A1MAPK1NPC1
SCHEMBL16235436 0.71 GAA (0.38) CCR4KMT2AALDH1A1MAPK1S100A9
SCHEMBL16235107 0.70 TP53 (0.39) CCR4MEN1KMT2AALDH1A1MAPK1
SCHEMBL16235503 0.70 S100A9 (0.52) CCR4S100A9

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