SCHEMBL6667752

SCHEMBL6667752

C=CC1CCC(c2ccc(C(F)(F)OC(C)c3ccc(C(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.40
TEAD1 P28347 3/20 0.35
TACR1 P25103 3/20 0.35
LIPE Q05469 1/20 0.32
CETP P11597 2/20 0.31
AKR1C3 P42330 1/20 0.31
AKR1C2 P52895 1/20 0.31

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
SCHEMBL6666728 0.96 HTR2C (0.33) HTR2CTEAD1TACR1
SCHEMBL6661104 0.92 ESR2 (0.35) HTR2CTACR1
SCHEMBL6666587 0.90
SCHEMBL6663937 0.90
SCHEMBL6664874 0.89 L3MBTL1 (0.34)
SCHEMBL6663968 0.89 ACACB (0.32)
SCHEMBL6663061 0.88 ALDH1A1 (0.40)
SCHEMBL6664066 0.88 ACACB (0.31)
SCHEMBL6662560 0.88 HSD11B1 (0.38) HTR2CTACR1
SCHEMBL6662956 0.88 ACACB (0.31)

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