SCHEMBL7543368

SCHEMBL7543368

COC(=O)Nc1ccc(OCc2nc3cc(C)ccc3o2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGPAT2 O15120 7/20 0.57
MAPT P10636 4/20 0.53
SMN1; SMN2 Q16637 7/20 0.48
RAB9A P51151 5/20 0.48
NPC1 O15118 4/20 0.48
LMNA P02545 1/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
TP53 P04637 2/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
POLB P06746 1/20 0.46
MAPK1 P28482 1/20 0.46
STAT1 P42224 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CETP P11597 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
SCHEMBL7542964 0.91 MAPT (0.56) AGPAT2MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL7550212 0.90 RAB9A (0.51) AGPAT2MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL7543732 0.88 AGPAT2 (0.58) AGPAT2MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL7544185 0.88 MAPT (0.49) AGPAT2MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL7541510 0.87 AGPAT2 (0.50) AGPAT2MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL7545924 0.87 MAPT (0.47) AGPAT2MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL7544976 0.85 AGPAT2 (0.58) AGPAT2MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL7542952 0.85 SMN1; SMN2 (0.57) AGPAT2MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL7545883 0.84 CETP (0.50) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL7543927 0.83 MAPT (0.56) MAPTSMN1; SMN2RAB9ANPC1TP53

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