SCHEMBL28224002

SCHEMBL28224002

CCCCCc1cccc(Br)c1C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.38
CNR1 P21554 6/20 0.37
CNR2 P34972 5/20 0.37
LIPG Q9Y5X9 1/20 0.37
ALOX5 P09917 1/20 0.37
PTGS2 P35354 1/20 0.37
BID P55957 3/20 0.35
MCL1 Q07820 3/20 0.35
BCL2L1 Q07817 2/20 0.35
BAK1 Q16611 2/20 0.35
KAT8 Q9H7Z6 2/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
EP300 Q09472 1/20 0.35
KAT2A Q92830 1/20 0.35
KAT2B Q92831 1/20 0.35
KAT5 Q92993 1/20 0.35
SAE1 Q9UBE0 1/20 0.35
RBP1 P09455 1/20 0.35

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
SCHEMBL28168404 0.95 BCHE (0.39) BCHECNR1CNR2
SCHEMBL28015329 0.89 EPHX2 (0.39) BCHECNR1CNR2
SCHEMBL16593924 0.84 BCHE (0.43) BCHECNR1CNR2LIPGALOX5
SCHEMBL28013083 0.83 GABRA1 (0.44)
SCHEMBL5678358 0.82 BID (0.38) BCHECNR1CNR2LIPGALOX5
SCHEMBL28187955 0.82 BID (0.48) CNR1CNR2LIPGALOX5PTGS2
SCHEMBL5680278 0.81 BID (0.40) BCHECNR1CNR2LIPGBID
SCHEMBL9756811 0.81 CNR1 (0.39) CNR1CNR2LIPGALOX5RBP1
SCHEMBL28198479 0.81 LIPG (0.40) BCHECNR1CNR2LIPGALOX5
SCHEMBL28270547 0.81 BID (0.50) CNR1CNR2LIPGALOX5PTGS2

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
CN-108192640-B Monomer liquid crystal with difluoromethoxy bridge bond low-viscosity giant electrothermal effect and preparation method thereof 西京学院 2021-05-28 CN disclosed
CN-111423891-A Synthesis method of 4- (trans-3-pentene) -4' -alkylcyclohexyl biphenyl liquid crystal compound 西安瑞联新材料股份有限公司 2020-07-17 CN disclosed
CN-111072446-A Preparation method of alkyl cyclohexyl bromobenzene 烟台坤益液晶显示材料有限公司 2020-04-28 CN disclosed
CN-108192640-A Monomer liquid crystal of the huge electrocaloric effect of difluoro methoxy bridge bond low viscosity and preparation method thereof 西京学院 2018-06-22 CN disclosed