SCHEMBL10936802

SCHEMBL10936802

N#C/C(=C\C=C\c1ccccc1)C([O])=O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.76
LMNA P02545 5/20 0.68
ALDH1A1 P00352 4/20 0.68
KDM4E B2RXH2 3/20 0.68
HTT P42858 1/20 0.68
MAPT P10636 1/20 0.68
HPGD P15428 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
KMT2A Q03164 3/20 0.64
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
GAA P10253 1/20 0.52
MAOB P27338 7/20 0.50
TRPA1 O75762 1/20 0.44
ALOX5 P09917 1/20 0.44
MAPK1 P28482 1/20 0.44
PKM P14618 2/20 0.43
HDAC3 O15379 1/20 0.43

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
SCHEMBL15082 0.89 MCL1 (0.76) MCL1LMNAALDH1A1KDM4EHTT
SCHEMBL8773598 0.89 MCL1 (0.76) MCL1LMNAALDH1A1KDM4EHTT
SCHEMBL15081 0.89 MCL1 (0.76) MCL1LMNAALDH1A1KDM4EHTT
Ammonia Solution, Strong SCHEMBL434911 0.88 MCL1 (0.73) MCL1LMNAALDH1A1KDM4EHTT
SCHEMBL9567343 0.86 MCL1 (0.71) MCL1LMNAALDH1A1KDM4EHTT
SCHEMBL3224150 0.86 MCL1 (0.71) MCL1LMNAALDH1A1KDM4EHTT
SCHEMBL14889223 0.86 MCL1 (0.71) MCL1LMNAALDH1A1KDM4EHTT
SCHEMBL9361168 0.83 MCL1 (0.67) MCL1LMNAALDH1A1KDM4EHTT
SCHEMBL9361177 0.83 MCL1 (0.67) MCL1LMNAALDH1A1KDM4EHTT
SCHEMBL8756597 0.82 MCL1 (0.66) MCL1LMNAALDH1A1KDM4EHTT

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-4495343-A Visible light-sensitive polyester polymer and visible light-sensitive resin composition containing said polymer TEIJIN LIMITED (JP) 1985-01-22 US disclosed