SCHEMBL10644341

SCHEMBL10644341

CC(Oc1ccc2ccc(Oc3ccc(C(F)(F)F)cc3Cl)cc2c1)C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.52
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TTR P02766 1/20 0.48
PPOX P50336 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
SCN9A Q15858 3/20 0.45
FPR2 P25090 2/20 0.45
HTR2A P28223 2/20 0.44
SLC6A4 P31645 2/20 0.44
KCNH2 Q12809 2/20 0.44
MRGPRX4 Q96LA9 3/20 0.40
SCN8A Q9UQD0 1/20 0.39
SCN10A Q9Y5Y9 1/20 0.39

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
SCHEMBL11258766 0.91 FFAR1 (0.59) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL8918684 0.90 FFAR1 (0.58) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL10642883 0.90 FFAR1 (0.53) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL204622 0.90 FFAR1 (0.58) FFAR1MEN1KMT2ATTRPPOX
Hydrochloric Acid SCHEMBL10642889 0.89 FFAR1 (0.57) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL941173 0.88 FFAR1 (0.51) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL29382403 0.88 FFAR1 (0.51) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL147772 0.88 FFAR1 (0.51) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL11442078 0.88 FFAR1 (0.53) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL10645967 0.87 FFAR1 (0.50) FFAR1MEN1KMT2ATTRPPOX

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0179015-B1 7-(ARYLOXY)-2-NAPHTHOXYALKANECARBOXYLIC ACID DERIVATIVES, PROCESSES FOR THE PREPARATION OF THESE COMPOUNDS, AS WELL AS AGENTS HAVING HERBICIDAL ACTIVITY CONTAINING THESE COMPOUNDS SCHERING AKTIENGESELLSCHAFT (DE) 1988-04-13 EP claimed
EP-0179015-A1 7-(Aryloxy)-2-naphthoxyalkanecarboxylic acid derivatives, processes for the preparation of these compounds, as well as agents having herbicidal activity containing these compounds SCHERING AKTIENGESELLSCHAFT (DE) 1986-04-23 EP claimed