SCHEMBL7693121

SCHEMBL7693121

CC=C(Oc1ccccc1C)C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
ATM Q13315 1/20 0.48
BCHE P06276 1/20 0.44
NPSR1 Q6W5P4 1/20 0.42
PPARG P37231 1/20 0.41
NOTUM Q6P988 1/20 0.40
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL7693114 0.87 TDP1 (0.42) TDP1L3MBTL1ATMBCHENPSR1
SCHEMBL7693116 0.87 TDP1 (0.42) TDP1L3MBTL1ATMBCHENPSR1
SCHEMBL9574063 0.86 TDP1 (0.44) TDP1L3MBTL1ATMBCHENPSR1
SCHEMBL7694447 0.84 NPSR1 (0.46) TDP1L3MBTL1ATMNPSR1NOTUM
SCHEMBL26419706 0.81 MAPT (0.41) NOTUMMEN1KMT2AKDM4EALDH1A1
SCHEMBL7694772 0.78 TSHR (0.47) NPSR1MEN1LMNAKMT2ASMN1; SMN2
SCHEMBL7693817 0.78 TSHR (0.41) MEN1KMT2AHPGD
SCHEMBL7064558 0.77 TDP1 (0.50) TDP1L3MBTL1ATMBCHENPSR1
SCHEMBL8026649 0.76 NOTUM (0.42) TDP1L3MBTL1NOTUMMEN1LMNA
SCHEMBL1598495 0.76 HPGD (0.61) TDP1L3MBTL1ATMBCHENPSR1

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
US-6337306-B1 HERBICIDES FOR AGRICULTURE RHONE-POULENC AGRO (FR) 2002-01-08 US disclosed
EP-0961766-A1 PHENOXYACETIC ACID DERIVATIVES AND THEIR USE AS HERBICIDES Rhone Poulenc Agro (FR) 1999-12-08 EP disclosed
WO-1998034898-A1 PHENOXYACETIC ACID DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRO (FR) 1998-08-13 WO disclosed