SCHEMBL14767285

SCHEMBL14767285

CCCCOc1ccc(-c2ccc(-c3ccc(C(=O)Oc4ccc(OCC)c(F)c4)cc3)c(F)c2F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
KMT2A Q03164 2/20 0.46
FFAR1 O14842 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
PRSS1 P07477 1/20 0.45
ACR P10323 1/20 0.45
LMNA P02545 3/20 0.45
NPC1 O15118 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
PTPN11 Q06124 1/20 0.43
FAAH O00519 2/20 0.43
RARB P10826 4/20 0.42

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
SCHEMBL14766984 0.96 KMT2A (0.48) MAPTKMT2AFFAR1FFAR4PRSS1
SCHEMBL14767108 0.94 MAPT (0.46) MAPTKMT2AFFAR1FFAR4PRSS1
SCHEMBL14766751 0.94 FFAR1 (0.46) MAPTKMT2AFFAR1FFAR4PRSS1
SCHEMBL14767299 0.93 MAPT (0.45) MAPTKMT2AFFAR1FFAR4LMNA
SCHEMBL14766300 0.92 RARB (0.47) MAPTKMT2AFFAR1FFAR4PRSS1
SCHEMBL14767137 0.92 FFAR1 (0.51) MAPTKMT2AFFAR1FFAR4PRSS1
SCHEMBL9405662 0.91 THRA (0.48) MAPTKMT2ALMNANPC1CYP1A2
SCHEMBL14767300 0.90 ALDH1A1 (0.44) MAPTKMT2AFFAR1FFAR4PRSS1
SCHEMBL14767139 0.90 FAAH (0.50) MAPTKMT2AFFAR1FFAR4PRSS1
SCHEMBL12742726 0.90 RARB (0.51) MAPTKMT2APRSS1ACRSMN1; SMN2

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