SCHEMBL7917956

SCHEMBL7917956

CCCC1CCN(c2ccc(-c3cc(F)c(C(F)(F)F)c(F)c3)cc2)CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 3/20 0.37
▸ HRH4 Q9H3N8 1/20 0.37
▸ FFAR4 Q5NUL3 6/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ DPP4 P27487 3/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ OPRM1 P35372 1/20 0.34
▸ OPRK1 P41145 1/20 0.34
▸ OPRL1 P41146 1/20 0.34
▸ CHRM4 P08173 1/20 0.34
▸ NOTUM Q6P988 1/20 0.33

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
SCHEMBL7912620 0.86 CHRM2 (0.40) HRH3FFAR4CHRM2DPP4CHRM4
SCHEMBL155535 0.79 HRH3 (0.52) HRH3FFAR4DPP4MAPK1HSD17B10
SCHEMBL12419707 0.79 HRH3 (0.54) HRH3HRH4CHRM2DPP4CHRM4
SCHEMBL13002680 0.78 CYP2C9 (0.48) FFAR4MAPK1OPRM1OPRK1OPRL1
SCHEMBL13002935 0.77 CYP2C9 (0.47) FFAR4MAPK1OPRM1OPRK1OPRL1
SCHEMBL7914429 0.77 SLC6A2 (0.48) HRH3DPP4
SCHEMBL12032030 0.75 CYP2C9 (0.42) MAPK1OPRM1OPRK1OPRL1
SCHEMBL13002438 0.75 FASN (0.36) MAPK1
SCHEMBL25666818 0.74 LGMN (0.41) CHRM2DPP4MAPK1CHRM4
SCHEMBL156068 0.74 ADRB1 (0.47) HRH3

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-1072593-A1 LIQUID CRYSTALLINE COMPOUND HAVING PIPERIDINE RING, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 2001-01-31 — — EP disclosed
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