SCHEMBL9634049

SCHEMBL9634049

CCCCNS(=O)(=O)c1cc(CC(C)=O)ccc1OC

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.60
ALDH1A1 P00352 4/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2C19 P33261 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.53
L3MBTL3 Q96JM7 1/20 0.50
MAPT P10636 2/20 0.49
LMNA P02545 2/20 0.49
HTT P42858 2/20 0.49
MAPK1 P28482 1/20 0.49
KDM4E B2RXH2 1/20 0.48
HPGD P15428 1/20 0.48
HSD17B10 Q99714 1/20 0.48
PKM P14618 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
USP2 O75604 1/20 0.46

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
SCHEMBL9632487 0.93 L3MBTL1 (0.62) POLBALDH1A1L3MBTL1L3MBTL3MAPT
SCHEMBL9633696 0.87 SMN1; SMN2 (0.60) POLBALDH1A1L3MBTL1MAPTKDM4E
SCHEMBL29265076 0.85 MAPT (0.49) POLBALDH1A1L3MBTL1MAPTPKM
SCHEMBL20314704 0.79 L3MBTL3 (0.74) POLBALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL24435822 0.77 L3MBTL1 (0.62) ALDH1A1CYP3A4L3MBTL1MAPTLMNA
SCHEMBL48765 0.76 PKM (0.57) ALDH1A1CYP3A4L3MBTL1MAPTHTT
SCHEMBL30997420 0.76 CA5A (0.47) POLBALDH1A1CYP3A4L3MBTL1MAPT
SCHEMBL30610782 0.76 PKM (0.57) ALDH1A1CYP3A4L3MBTL1MAPTHTT
SCHEMBL4660848 0.76 CA5A (0.47) POLBALDH1A1CYP3A4L3MBTL1MAPT
SCHEMBL13185619 0.76 ALPL (0.56) POLBALDH1A1L3MBTL1L3MBTL3MAPT

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