SCHEMBL7544498

SCHEMBL7544498

COC(=O)N(C(=O)c1ccco1)c1ccc(OCc2nc3ccccc3o2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.43
MAPT P10636 3/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 2/20 0.38
HPGD P15428 1/20 0.38
LMNA P02545 2/20 0.37
ALOX5AP P20292 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
CYP2C19 P33261 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SIRT5 Q9NXA8 1/20 0.36
PPARD Q03181 3/20 0.36
PPARG P37231 2/20 0.36
PPARA Q07869 1/20 0.36
TSHR P16473 1/20 0.35
ALOX5 P09917 1/20 0.35

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
SCHEMBL7548833 0.89 PDE10A (0.47) PDE10AMAPTALDH1A1MAPK1HPGD
SCHEMBL7545435 0.88 PDE10A (0.47) PDE10AMAPTLMNAALOX5APCYP1A2
SCHEMBL7542088 0.85 PDE10A (0.44) PDE10AALDH1A1MAPK1HPGDLMNA
SCHEMBL7548710 0.85 PDE10A (0.44) PDE10AMAPTALDH1A1MAPK1HPGD
SCHEMBL7541458 0.85 PDE10A (0.44) PDE10AALDH1A1MAPK1HPGDLMNA
SCHEMBL7549402 0.84 PDE10A (0.43) PDE10AMAPTALDH1A1LMNAMEN1
SCHEMBL7549521 0.83 PDE10A (0.43) PDE10AMAPTALDH1A1LMNAALOX5AP
SCHEMBL7542014 0.82 PDE10A (0.51) PDE10AMAPTALDH1A1MAPK1HPGD
SCHEMBL8665024 0.82 PDE10A (0.42) PDE10AMAPTLMNAALOX5APCYP1A2
SCHEMBL7543738 0.82 TP53 (0.43) PDE10AMAPTALDH1A1MAPK1HPGD

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