SCHEMBL7544690

SCHEMBL7544690

COc1ccc2nc(CSc3ccc(NC(C)=O)cc3)sc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 12/20 0.60
▸ HPGD P15428 4/20 0.60
▸ MEN1 O00255 4/20 0.60
▸ KMT2A Q03164 4/20 0.60
▸ ALDH1A1 P00352 3/20 0.60
▸ KDM4E B2RXH2 3/20 0.60
▸ TDP1 Q9NUW8 3/20 0.60
▸ HTT P42858 2/20 0.60
▸ GAA P10253 2/20 0.60
▸ NPC1 O15118 3/20 0.58
▸ RAB9A P51151 3/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ CYP1A2 P05177 1/20 0.58
▸ CYP3A4 P08684 1/20 0.58
▸ CYP2C19 P33261 1/20 0.58
▸ DYRK1A Q13627 1/20 0.58
▸ MAPK1 P28482 2/20 0.57
▸ LMNA P02545 4/20 0.52
▸ RECQL P46063 3/20 0.52
▸ POLB P06746 2/20 0.52

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
SCHEMBL7542768 0.84 MAPT (0.64) MAPTHPGDMEN1KMT2AALDH1A1
SCHEMBL7548719 0.82 ALOX5 (0.68) MAPTHPGDMEN1KMT2AALDH1A1
SCHEMBL7541753 0.78 DYRK1A (0.56) MAPTMEN1KMT2AALDH1A1GAA
SCHEMBL7551697 0.76 ALOX5 (0.66) MAPTHPGDMEN1KMT2AALDH1A1
SCHEMBL7548568 0.75 NPC1 (0.61) MAPTHPGDMEN1KMT2AALDH1A1
SCHEMBL4910697 0.75 SCD (0.82) MAPTHPGDMEN1KMT2AALDH1A1
SCHEMBL7545050 0.75 MAPT (0.58) MAPTHPGDMEN1KMT2AALDH1A1
SCHEMBL4918595 0.74 NPC1 (1.00) MAPTHPGDMEN1KMT2AALDH1A1
SCHEMBL7544842 0.74 MAPT (0.68) MAPTHPGDMEN1KMT2AALDH1A1
SCHEMBL11338493 0.73 CYP1A2 (0.63) MAPTMEN1KMT2AALDH1A1HTT

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-0795550-B1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO CO (JP) 2002-06-05 — — EP disclosed
US-5736487-A HERBICIDES SANKYO COMPANY, LIMITED (JP) 1998-04-07 — — US disclosed
EP-0795550-A1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO COMPANY LIMITED (JP) 1997-09-17 — — EP disclosed
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