SCHEMBL15744997

SCHEMBL15744997

CCCc1ccc2cc(-c3ccc(COc4cc(F)c(-c5cc(F)c(C(F)(F)OC(F)(F)F)c(F)c5)c(F)c4)cc3)ccc2c1

nearest known ligand 0.32

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.32
PPARD Q03181 3/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
HRH3 Q9Y5N1 3/20 0.32
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
PPARA Q07869 1/20 0.30
PTGES O14684 1/20 0.30

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
SCHEMBL15744939 0.95 PPARD (0.35) FFAR1PPARDHRH3SENP8SENP7
SCHEMBL15744846 0.95 PPARD (0.35) FFAR1PPARDHRH3SENP8SENP7
SCHEMBL15745117 0.92 FFAR1 (0.32) FFAR1ESR1ESR2
SCHEMBL15744588 0.92 HRH3 (0.35) ESR1ESR2HRH3
SCHEMBL15744503 0.90 ESR1 (0.34) ESR1ESR2HRH3
SCHEMBL15744344 0.90 SENP8 (0.37) FFAR1HRH3SENP8SENP7SENP6
SCHEMBL15745088 0.89 HDAC1 (0.38) FFAR1PPARDHRH3
SCHEMBL15744943 0.88 S1PR1 (0.36) FFAR1PPARDSENP8SENP7SENP6
SCHEMBL15744353 0.88 FFAR4 (0.32) FFAR1PPARDESR1ESR2HRH3
SCHEMBL15744498 0.87 HRH3 (0.38) ESR1ESR2HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9365774-B2 Liquid crystal compound having CF2OCF3 at terminal, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-06-14 US disclosed
US-9365774-B2 Liquid crystal compound having CF2OCF3 at terminal, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-06-14 US disclosed
US-20140145113-A1 LIQUID CRYSTAL COMPOUND HAVING CF2OCF3 AT TERMINAL, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-05-29 US disclosed
US-20140145113-A1 LIQUID CRYSTAL COMPOUND HAVING CF2OCF3 AT TERMINAL, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-05-29 US disclosed