SCHEMBL10646293

SCHEMBL10646293

COCCOC(=O)[C@@H](C)Oc1ccc2ccc(Oc3ccc(C(F)(F)F)cc3Cl)cc2c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.49
KMT2A Q03164 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
MEN1 O00255 2/20 0.44
TTR P02766 1/20 0.44
PPOX P50336 1/20 0.44
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41
MRGPRX4 Q96LA9 3/20 0.40
HTR2A P28223 2/20 0.40
SLC6A4 P31645 2/20 0.40
KCNH2 Q12809 2/20 0.40
GAA P10253 1/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 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
SCHEMBL10643355 1.00 FFAR1 (0.49) FFAR1KMT2ATDP1MEN1TTR
SCHEMBL10644002 0.91 FFAR1 (0.50) FFAR1KMT2ATDP1MEN1TTR
SCHEMBL10643331 0.91 FFAR1 (0.50) FFAR1KMT2ATDP1MEN1TTR
SCHEMBL10643788 0.90 TDP1 (0.51) FFAR1KMT2ATDP1MEN1TTR
SCHEMBL10644057 0.90 TDP1 (0.51) FFAR1KMT2ATDP1MEN1TTR
SCHEMBL10643426 0.90 FFAR1 (0.49) FFAR1KMT2ATDP1MEN1TTR
SCHEMBL10646337 0.90 FFAR1 (0.49) FFAR1KMT2ATDP1MEN1TTR
SCHEMBL9633459 0.89 FFAR1 (0.52) FFAR1KMT2ATDP1MEN1TTR
SCHEMBL10643884 0.89 FFAR1 (0.52) FFAR1KMT2ATDP1MEN1TTR
SCHEMBL10644204 0.89 FFAR1 (0.52) FFAR1KMT2ATDP1MEN1TTR

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-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
US-4709077-A 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) 1987-11-24 US 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