SCHEMBL9999654

SCHEMBL9999654

COCc1cc(C2CCC(c3cc(COC)c(OC)c(COC)c3)(c3cc(COC)c(OC)c(COC)c3)CC2)cc(COC)c1OC

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL19852866 0.87
SCHEMBL12285105 0.83
SCHEMBL9999655 0.81
SCHEMBL9999653 0.69 ESR2 (0.37) ESR2
SCHEMBL25636444 0.67 PRKCE (0.35)
SCHEMBL19901957 0.66 MAPT (0.33)
SCHEMBL18162711 0.65 ALDH1A1 (0.39)
SCHEMBL18100880 0.65 ACHE (0.34) ESR2
SCHEMBL19680382 0.65 ACHE (0.55) ESR1ESR2
SCHEMBL18220628 0.64 ACHE (0.42) ESR1ESR2

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
WO-2012014898-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学工業株式会社 (JP) 2012-02-02 WO disclosed