SCHEMBL14766769

SCHEMBL14766769

C=CCOc1ccc(C2CCC(C(=O)Oc3ccc(C4CCC(OCC)CC4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.35
MTNR1A P48039 2/20 0.35
POLB P06746 2/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
HCRTR2 O43614 3/20 0.33
GPR119 Q8TDV5 2/20 0.33
ALDH1A1 P00352 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 2/20 0.31
MAPT P10636 2/20 0.31
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KAT6A Q92794 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
PPARD Q03181 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
SCHEMBL14766980 0.95 POLB (0.39) HPGDMTNR1APOLBTSHRMAPK1
SCHEMBL14766421 0.91 HPGD (0.35) HPGDHCRTR2GPR119PPARD
SCHEMBL12737263 0.91 MTNR1A (0.36) HPGDMTNR1APOLBTSHRMAPK1
SCHEMBL14766272 0.91 HPGD (0.39) HPGDMTNR1AHCRTR2GPR119PPARD
SCHEMBL14767260 0.90 POLB (0.35) HPGDMTNR1APOLBTSHRMAPK1
SCHEMBL14766329 0.90 HPGD (0.37) HPGDPOLBTSHRMAPK1HCRTR2
SCHEMBL14767258 0.90 HPGD (0.37) HPGDPOLBTSHRMAPK1HCRTR2
SCHEMBL12717377 0.88 POLB (0.35) HPGDMTNR1APOLBTSHRMAPK1
SCHEMBL14767172 0.87 HPGD (0.35) HPGDPOLBTSHRMAPK1HCRTR2
SCHEMBL14766343 0.87 HPGD (0.37) HPGDPOLBTSHRMAPK1HCRTR2

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