SCHEMBL20146986

SCHEMBL20146986

COCCOCCOc1ccc(-c2cc3c(s2)C(c2ccc(C(C)(C)C)cc2)(c2ccc(C(C)(C)C)cc2)c2sc(-c4cc(C)c(OCCOCCOC)c(C)c4)cc2C2=C3C(F)(F)C(C)(F)C2(F)F)cc1C

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL17617006 0.91
SCHEMBL20146985 0.88
SCHEMBL14838524 0.80
SCHEMBL17617005 0.78
SCHEMBL15183074 0.78 TNKS (0.34)
SCHEMBL17617001 0.73 KDM4E (0.33) KDM4EALDH1A1
SCHEMBL20147075 0.73 CHEK1 (0.34)
SCHEMBL10002014 0.72 PRKDC (0.34)
SCHEMBL20147035 0.70
SCHEMBL17617021 0.70 PRKDC (0.32)

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-2760969-B1 DIARYLETHENE COMPOUNDS AND USES THEREOF SWITCH MAT INC (CA) 2018-05-16 EP disclosed