SCHEMBL7912620

SCHEMBL7912620

CCCC1CCN(c2ccc(-c3ccc(F)c(F)c3)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 2/20 0.40
▸ FFAR4 Q5NUL3 6/20 0.37
▸ HRH3 Q9Y5N1 2/20 0.36
▸ CHRM4 P08173 2/20 0.35
▸ DPP4 P27487 2/20 0.35
▸ DPP8 Q6V1X1 2/20 0.35
▸ DPP9 Q86TI2 2/20 0.35
▸ DPP7 Q9UHL4 2/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CHRM3 P20309 1/20 0.34

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
SCHEMBL7917956 0.86 HRH3 (0.37) CHRM2FFAR4HRH3CHRM4DPP4
SCHEMBL155535 0.81 HRH3 (0.52) FFAR4HRH3CHRM4DPP4ALDH1A1
SCHEMBL7914429 0.79 SLC6A2 (0.48) HRH3DPP4
SCHEMBL29432469 0.77 CYP2C9 (0.50) MEN1ALDH1A1KMT2A
SCHEMBL7756528 0.77 CYP2C9 (0.50) MEN1ALDH1A1KMT2A
SCHEMBL3437362 0.77 CYP2C9 (0.50) MEN1ALDH1A1KMT2A
SCHEMBL10345128 0.77 CYP17A1 (0.42) HRH3
SCHEMBL10723905 0.76 CYP17A1 (0.41) HRH3
SCHEMBL10723919 0.76 CYP17A1 (0.41) HRH3
SCHEMBL25666818 0.76 LGMN (0.41) CHRM2CHRM4DPP4DPP8DPP9

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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