SCHEMBL7913753

SCHEMBL7913753

COCOC1CCC(c2ccc(-c3ccc(C(F)(F)C(F)C(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.31
DGAT1 O75907 1/20 0.31
SOAT1 P35610 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
IDO1 P14902 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
SCHEMBL7903467 0.93 HTR2C (0.31) HTR2CIDO1
SCHEMBL7913794 0.89 IDO1 (0.31) HTR2CDGAT1SOAT1IDO1
SCHEMBL7913544 0.86 ALDH1A1 (0.38) L3MBTL1
SCHEMBL7917572 0.85 NAAA (0.31)
SCHEMBL7903736 0.85 CYP11B1 (0.34)
SCHEMBL7913858 0.83 DGAT1 (0.34) HTR2CDGAT1SOAT1L3MBTL1IDO1
SCHEMBL7917577 0.83 MAOB (0.33)
SCHEMBL7911161 0.82 IDO1 (0.31) HTR2CIDO1
SCHEMBL7917331 0.82 ALDH1A1 (0.40) L3MBTL1IDO1
SCHEMBL8834342 0.80 FFAR4 (0.32)

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-0640578-B2 Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition CHISSO CORP (JP) 2001-06-27 EP disclosed
EP-0640578-B1 Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition CHISSO CORP (JP) 1997-11-05 EP disclosed
EP-0640578-A1 Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition Chisso Corporation (JP) 1995-03-01 EP disclosed