SCHEMBL8745176

SCHEMBL8745176

CCCCCC1CCC(C2CCC(CCC=Cc3ccc(F)c(F)c3)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.36
MAPT P10636 1/20 0.33
ATM Q13315 1/20 0.33
TRPA1 O75762 1/20 0.33
TNNC1 P63316 1/20 0.32
PABPC1 P11940 1/20 0.30
RAB9A P51151 1/20 0.30
EIF4H Q15056 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
SCHEMBL8745260 0.96 NFE2L2 (0.39) NFE2L2MAPTATMTRPA1TNNC1
SCHEMBL8745169 0.91 NFE2L2 (0.39) NFE2L2TRPA1PABPC1RAB9AEIF4H
SCHEMBL8745224 0.89 NFE2L2 (0.39) NFE2L2TRPA1PABPC1RAB9AEIF4H
SCHEMBL8745188 0.88 PKM (0.30) TRPA1
SCHEMBL8745628 0.87 NFE2L2 (0.41) NFE2L2MAPTATMTRPA1PABPC1
SCHEMBL8747211 0.87 MAPT (0.31) MAPTATM
SCHEMBL8745261 0.86 TNNC1 (0.36) NFE2L2MAPTTRPA1TNNC1
SCHEMBL9139977 0.86 EPHX2 (0.34) MAPTATM
SCHEMBL8745250 0.84 NFE2L2 (0.41) NFE2L2TRPA1PABPC1RAB9AEIF4H
SCHEMBL8745171 0.83 PKM (0.32) MAPTATMTRPA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0563981-B1 Cis-1,4-substituted 2-butene derivative CHISSO CORP (JP) 1997-01-22 EP disclosed
US-5401434-A Cis-1,4-substituted 2-butene derivative CHISSO CORPORATION (JP) 1995-03-28 US disclosed
EP-0563981-A2 Cis-1,4-substituted 2-butene derivative Chisso Corporation (JP) 1993-10-06 EP disclosed