SCHEMBL9515259

SCHEMBL9515259

CC(=O)Cc1ccc(CC2SC(=N)NC2=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.64
MAPT P10636 4/20 0.49
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HPGD P15428 2/20 0.47
GLA P06280 1/20 0.47
ALOX12 P18054 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KDM4E B2RXH2 2/20 0.45
HIF1A Q16665 2/20 0.45
PTBP1 P26599 1/20 0.44
PPARG P37231 5/20 0.44
MAOA P21397 2/20 0.42
CISD1 Q9NZ45 2/20 0.42
CA2 P00918 1/20 0.42

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
SCHEMBL9516553 0.87 MAPT (0.65) MAOBMAPTLMNAHTTSMN1; SMN2
SCHEMBL9570622 0.86 MAOB (0.83) MAOBMAPTLMNAHTTSMN1; SMN2
SCHEMBL5213619 0.82 MAOB (0.71) MAOBMAPTLMNAHTTSMN1; SMN2
SCHEMBL1520158 0.79 MAOB (0.71) MAOBMAPTLMNAHTTSMN1; SMN2
SCHEMBL1520824 0.79 MAOB (1.00) MAOBMAPTLMNAMEN1KMT2A
SCHEMBL9570681 0.78 MAOB (0.69) MAOBMAPTLMNAHTTSMN1; SMN2
SCHEMBL4221515 0.76 MAOB (0.62) MAOBMAPTHPGDMEN1KMT2A
SCHEMBL9570559 0.72 MAPT (0.83) MAOBMAPTHPGDMEN1KMT2A
SCHEMBL12521889 0.72 MAOB (0.74) MAOBPPARGCA2FFAR1PPARA
SCHEMBL9570601 0.72 MAOB (0.61) MAOBMAPTLMNAHTTSMN1; SMN2

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-0236624-B1 SUBSTITUTED PHENYL ETHANOL AMINES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 1993-08-11 EP disclosed
US-5153210-A Hypoglycemic agent, animal growth regulator; veterinary medicine BEECHAM GROUP P.L.C. (GB) 1992-10-06 US disclosed
EP-0236624-A2 Substituted phenyl ethanol amines, processes for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1987-09-16 EP disclosed