SCHEMBL14767172

SCHEMBL14767172

C=CCCOc1ccc(OC(=O)C2CCC(c3ccc(C4CCC(OCC)CC4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.35
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
PPARD Q03181 8/20 0.33
SCN9A Q15858 1/20 0.33
HCRTR2 O43614 1/20 0.32
ACACB O00763 1/20 0.32
PPARA Q07869 3/20 0.32
FAAH O00519 1/20 0.32
PPARG P37231 2/20 0.31
CRBN Q96SW2 1/20 0.31
FFAR1 O14842 2/20 0.31

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
SCHEMBL14766421 0.96 HPGD (0.35) HPGDPPARDSCN9AHCRTR2ACACB
SCHEMBL14767247 0.94 FAAH (0.35) HPGDPOLBTSHRMAPK1PPARD
SCHEMBL14767307 0.94 HPGD (0.34) HPGDPOLBTSHRMAPK1PPARD
SCHEMBL14766978 0.91 FAAH (0.36) HPGDPOLBTSHRMAPK1PPARD
SCHEMBL14766980 0.91 POLB (0.39) HPGDPOLBTSHRMAPK1PPARD
SCHEMBL12742208 0.90 MAPK1 (0.35) HPGDPOLBTSHRMAPK1PPARD
SCHEMBL14766729 0.90 HPGD (0.37) HPGDSCN9AHCRTR2ACACB
SCHEMBL14766757 0.90 HPGD (0.37) HPGDSCN9AHCRTR2ACACB
SCHEMBL14766016 0.90 SCN9A (0.35) HPGDPPARDSCN9AHCRTR2ACACB
SCHEMBL14767305 0.89 HPGD (0.39) HPGDPPARDHCRTR2FFAR1

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