SCHEMBL20173256

SCHEMBL20173256

CCCCC1CCC(C2COC(c3cc(F)c(C)c(F)c3)OC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 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
SCHEMBL20173254 0.96 CYP1A2 (0.31) CYP1A2
SCHEMBL20173257 0.92 TLR4 (0.32)
SCHEMBL20174023 0.91 CYP1A2 (0.33) CYP1A2
SCHEMBL25573816 0.88 ESR2 (0.31)
SCHEMBL13002703 0.88 CYP1A2 (0.31) CYP1A2
SCHEMBL14274416 0.87 CYP1A2 (0.32) CYP1A2
SCHEMBL16405324 0.87
SCHEMBL9556296 0.86 TP53 (0.32) CYP1A2
SCHEMBL9556298 0.86 TP53 (0.32) CYP1A2
SCHEMBL9407046 0.85

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
US-20180142154-A1 LIQUID CRYSTAL COMPOSITION HAVING GOOD PHOTOSTABILITY AND THERMOSTABILITY, AND LIQUID CRYSTAL DISPLAY ELEMENT JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2018-05-24 US disclosed