SCHEMBL9632495

SCHEMBL9632495

CCOc1ccc(CC(C)=O)cc1S(=O)(=O)NC

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
PKM P14618 1/20 0.43
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
TSHR P16473 1/20 0.41
POLB P06746 2/20 0.40
MAPT P10636 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALPL P05186 2/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL9632900 0.83 CA12 (0.48) ALDH1A1PKMPOLBMAPTCYP1A2
SCHEMBL9632885 0.81 MAPT (0.49) ALDH1A1PKMGAAMEN1KMT2A
SCHEMBL27685761 0.78 ALDH1A1 (0.58) ALDH1A1GAAL3MBTL1MEN1KMT2A
SCHEMBL9633696 0.76 SMN1; SMN2 (0.60) ALDH1A1PKMGAAL3MBTL1POLB
SCHEMBL17577750 0.75 TAS1R3 (0.48) ALDH1A1MEN1KMT2ATSHRPOLB
SCHEMBL10725628 0.74 CREBBP (0.62) ALDH1A1GAAL3MBTL1MEN1KMT2A
SCHEMBL10725513 0.74 MAPT (0.54) ALDH1A1GAAL3MBTL1MEN1KMT2A
SCHEMBL9632487 0.74 L3MBTL1 (0.62) ALDH1A1PKML3MBTL1POLBMAPT
SCHEMBL9633753 0.73 ADRA1D (0.41) ALDH1A1PKMGAAL3MBTL1MEN1
SCHEMBL9632001 0.72 ATM (0.43) PKMMEN1KMT2ATSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0331943-B1 PHENOXYETHYLAMINE DERIVATIVES, PROCESS FOR PREPARING THE SAME, AND COMPOSITION FOR EXHIBITING EXCELLENT ALPHA-1-BLOCKING ACTIVITY CONTAINING THE SAME Hokuriku Pharmaceutical Co.,Ltd (JP) 1992-06-17 EP disclosed
US-4971990-A HYPOTENSIVE AGENTS, DYSUREA HOKURIKU PHARMACEUTICAL CO., LTD. (JP) 1990-11-20 US disclosed
EP-0331943-A1 Phenoxyethylamine derivatives, process for preparing the same, and composition for exhibiting excellent alpha-1-blocking activity containing the same Hokuriku Pharmaceutical Co.,Ltd (JP) 1989-09-13 EP disclosed