SCHEMBL10030799

SCHEMBL10030799

Cc1ccc(C2CCCCC2)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 2/20 0.38
FEN1 P39748 7/20 0.37
CEL P19835 2/20 0.37
PSMB5 P28074 2/20 0.36
ALOX5AP P20292 5/20 0.35
HPGD P15428 1/20 0.35
PTGS2 P35354 1/20 0.35
HTR2C P28335 2/20 0.34

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
SCHEMBL12716351 0.98 OPRL1 (0.40) OPRL1FEN1CELPSMB5ALOX5AP
SCHEMBL20312053 0.98 OPRL1 (0.37) OPRL1FEN1CELPSMB5ALOX5AP
SCHEMBL19984707 0.90 NOTUM (0.38) OPRL1HPGDHTR2C
SCHEMBL21915666 0.90 NOTUM (0.38) OPRL1HPGDHTR2C
SCHEMBL12018637 0.89 OPRL1 (0.38) OPRL1FEN1CELHPGDHTR2C
SCHEMBL16768989 0.87 OPRL1 (0.37) OPRL1FEN1ALOX5APHPGDHTR2C
SCHEMBL16769046 0.87 OPRL1 (0.37) OPRL1FEN1ALOX5APHPGDHTR2C
SCHEMBL13545695 0.86 HTR2C (0.44) OPRL1FEN1CELPTGS2HTR2C
SCHEMBL9628619 0.84 HTR2C (0.46) OPRL1FEN1ALOX5APPTGS2HTR2C
SCHEMBL21472152 0.84 OPRL1 (0.35) OPRL1FEN1ALOX5APHTR2C

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
WO-2021134883-A1 LIQUID CRYSTAL COMPOSITION OF NEGATIVE LIQUID CRYSTAL COMPOUND HAVING METHOXY BRIDGE BOND AND USE THEREOF 北京八亿时空液晶科技股份有限公司 2021-07-08 WO disclosed
WO-2021134885-A1 HIGH-CONTRAST NEGATIVE LIQUID CRYSTAL COMPOSITION CONTAINING PHENYLPROPYLTHIOPHENE AND APPLICATION THEREOF 北京八亿时空液晶科技股份有限公司 2021-07-08 WO disclosed
EP-3095834-A2 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME Merck Patent GmbH (DE) 2016-11-23 EP disclosed
EP-2239310-B1 Liquid crystal medium and liquid crystal display MERCK PATENT GMBH (DE) 2012-06-27 EP disclosed