SCHEMBL19854576

SCHEMBL19854576

C=C(CO)C(=O)Oc1cc(OC(O)C(=C)CO)cc(C2CCC(CCCCC)CC2)c1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.31
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 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
SCHEMBL20313486 0.90 CYP2C9 (0.36) CYP2C9MEN1MAPTKMT2A
SCHEMBL19855166 0.87 CYP2C9 (0.32) CYP2C9MEN1MAPTKMT2A
SCHEMBL20313621 0.83 CYP2C9 (0.32) CYP2C9MEN1MAPTKMT2A
SCHEMBL19855157 0.83 CYP2C9 (0.32) CYP2C9MEN1MAPTKMT2A
SCHEMBL20313629 0.83 CYP2C9 (0.32) CYP2C9MEN1MAPTKMT2A
SCHEMBL19855547 0.81 CYP2C9 (0.40) CYP2C9MEN1MAPTKMT2A
SCHEMBL19854418 0.81 CYP2C9 (0.40) CYP2C9MEN1MAPTKMT2A
SCHEMBL20313536 0.80 CYP2C9 (0.44) CYP2C9MEN1MAPTKMT2A
SCHEMBL19721839 0.80 CYP2C9 (0.44) CYP2C9MEN1MAPTKMT2A
SCHEMBL19722188 0.79 CYP2C9 (0.43) CYP2C9MEN1MAPTKMT2A

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-2018025974-A1 LIQUID-CRYSTAL DISPLAY ELEMENT AND DISPLAY DEVICE JNC株式会社 2018-02-08 WO disclosed