SCHEMBL14766819

SCHEMBL14766819

C=CCCOc1ccc(OC(=O)C2CCC(c3ccc(-c4ccc(OCC)cc4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.38
FFAR4 Q5NUL3 4/20 0.38
PPARD Q03181 6/20 0.36
HPGD P15428 4/20 0.35
PPARA Q07869 2/20 0.32
PPARG P37231 1/20 0.32
CAMKK1 Q8N5S9 1/20 0.32
CAMKK2 Q96RR4 1/20 0.32
JAK1 P23458 1/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL14767220 0.95 FAAH (0.36) FFAR1FFAR4PPARD
SCHEMBL14766502 0.94 FFAR1 (0.41) FFAR1FFAR4PPARDHPGDPPARA
SCHEMBL14767183 0.94 FFAR1 (0.36) FFAR1FFAR4PPARDHPGDCAMKK1
SCHEMBL14767136 0.94 FFAR4 (0.36) FFAR1FFAR4PPARDHPGD
SCHEMBL12742451 0.93 CYP2C9 (0.35) FFAR1FFAR4PPARDPPARAPPARG
SCHEMBL14767156 0.92 FFAR1 (0.37) FFAR1FFAR4PPARDHPGDCAMKK1
SCHEMBL14766194 0.92 HPGD (0.35) FFAR1FFAR4PPARDHPGDJAK1
SCHEMBL14767250 0.92 HPGD (0.35) FFAR1FFAR4PPARDHPGDJAK1
SCHEMBL14767209 0.92 FFAR1 (0.41) FFAR1FFAR4PPARDHPGDCAMKK1
SCHEMBL14767134 0.91 FFAR1 (0.43) FFAR1FFAR4PPARDHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed