SCHEMBL7541510

SCHEMBL7541510

COC(=O)Nc1ccc(OCc2nc3cc(C)ccc3o2)cc1C

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AGPAT2 O15120 3/20 0.50
KDR P35968 4/20 0.43
MAPT P10636 4/20 0.43
HPGD P15428 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
RXFP1 Q9HBX9 2/20 0.41
LMNA P02545 1/20 0.41
EGFR P00533 2/20 0.41
TP53 P04637 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ALOX5 P09917 1/20 0.41
EPHX2 P34913 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL7547607 0.93 MAPT (0.46) AGPAT2KDRMAPTHPGDMEN1
SCHEMBL7542942 0.92 AGPAT2 (0.43) AGPAT2KDRMAPTMEN1KMT2A
SCHEMBL7550333 0.92 MAPT (0.46) AGPAT2KDRMAPTHPGDMEN1
SCHEMBL7544792 0.91 AGPAT2 (0.51) AGPAT2MAPTHPGDMEN1KMT2A
SCHEMBL7545106 0.91 CEPT1 (0.42) AGPAT2KDRMAPTRXFP1LMNA
SCHEMBL7547344 0.90 ALOX5AP (0.43) AGPAT2KDRMAPTSMN1; SMN2RXFP1
SCHEMBL7541413 0.89 LMNA (0.47) AGPAT2KDRMAPTHPGDMEN1
SCHEMBL7543714 0.88 AGPAT2 (0.48) AGPAT2KDRMAPTRXFP1LMNA
SCHEMBL7543368 0.87 AGPAT2 (0.57) AGPAT2MAPTHPGDKMT2ASMN1; SMN2
SCHEMBL7542502 0.86 MAPT (0.46) KDRMAPTMEN1KMT2ASMN1; 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-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