SCHEMBL19560293

SCHEMBL19560293

C=C(C)C(=O)O/C=C/COc1ccc(-c2ccc(-c3ccc(OC/C=C/OC)cc3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HDAC3 O15379 4/20 0.33
HDAC4 P56524 4/20 0.33
HDAC1 Q13547 4/20 0.33
HDAC7 Q8WUI4 4/20 0.33
HDAC2 Q92769 4/20 0.33
HDAC10 Q969S8 4/20 0.33
HDAC11 Q96DB2 4/20 0.33
HDAC8 Q9BY41 4/20 0.33
HDAC6 Q9UBN7 4/20 0.33
HDAC9 Q9UKV0 4/20 0.33
HDAC5 Q9UQL6 4/20 0.33
PPARD Q03181 4/20 0.33
PPARA Q07869 4/20 0.33
PPARG P37231 1/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 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
SCHEMBL16518524 0.94 HTT (0.40) HTTPOLBAPEX1TDP1HDAC3
SCHEMBL16518475 0.94 HTT (0.40) HTTPOLBAPEX1TDP1HDAC3
SCHEMBL19560360 0.89 HTT (0.36) HTTPOLBAPEX1TDP1HDAC3
SCHEMBL27839265 0.83 AOC3 (0.44) HTTPOLBAPEX1TDP1PPARD
SCHEMBL8627217 0.82 HTT (0.56) HTTPOLBAPEX1TDP1ELANE
Hydrochloric Acid SCHEMBL10790972 0.81 HTT (0.54) HTTPOLBAPEX1TDP1ELANE
SCHEMBL16518478 0.81 POLB (0.44) HTTPOLBAPEX1TDP1HDAC3
SCHEMBL16518532 0.81 POLB (0.44) HTTPOLBAPEX1TDP1HDAC3
SCHEMBL16518537 0.79 HTT (0.47) HTTPOLBAPEX1TDP1PPARD
SCHEMBL16518464 0.79 HTT (0.47) HTTPOLBAPEX1TDP1PPARD

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-2871175-B1 POLYMERIZABLE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2017-11-08 EP disclosed