SCHEMBL6664148

SCHEMBL6664148

C=CCCC1CCC(c2ccc(C(F)(F)OC(C)c3cc(F)c(C#N)c(F)c3)cc2)CC1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.30
CETP P11597 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
SCHEMBL6667727 0.90
SCHEMBL6661300 0.89 CYP11B1 (0.31)
SCHEMBL6664197 0.89 TACR1 (0.34) TACR1
SCHEMBL6666944 0.89 ALDH1A1 (0.38) TACR1CETP
SCHEMBL6662862 0.89 TACR1 (0.32) TACR1
SCHEMBL6664346 0.86 TACR1 (0.31) TACR1
SCHEMBL6663175 0.86 ALDH1A1 (0.32) TACR1CETP
SCHEMBL6666330 0.86 HSD11B1 (0.36) CETP
SCHEMBL6665868 0.85 ACACB (0.33) TACR1
SCHEMBL6666991 0.84 PDE2A (0.33) TACR1

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
EP-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed