SCHEMBL10936955

SCHEMBL10936955

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

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.57
LMNA P02545 6/20 0.51
ALDH1A1 P00352 3/20 0.51
MAPT P10636 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HTT P42858 1/20 0.51
KDM4E B2RXH2 1/20 0.51
HPGD P15428 1/20 0.51
KMT2A Q03164 2/20 0.49
MAOB P27338 1/20 0.45
APP P05067 4/20 0.44
TRPA1 O75762 1/20 0.44
ALOX5 P09917 1/20 0.44
MAPK1 P28482 1/20 0.44
SNCA P37840 2/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
GAA P10253 1/20 0.40

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
SCHEMBL9417087 0.89 MCL1 (0.59) MCL1LMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL6278918 0.89 MCL1 (0.59) MCL1LMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL5386095 0.77 MAPT (0.58) MCL1LMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL5386096 0.77 MAPT (0.58) MCL1LMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL15081 0.75 MCL1 (0.76) MCL1LMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL10936802 0.75 MCL1 (0.76) MCL1LMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL8773598 0.75 MCL1 (0.76) MCL1LMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL15082 0.75 MCL1 (0.76) MCL1LMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL11300858 0.74 MAOB (0.48) MCL1LMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL83957 0.74 MCL1 (0.56) MCL1LMNAALDH1A1MAPTSMN1; SMN2

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