SCHEMBL7517347

SCHEMBL7517347

C/C(=C\CC(O)Cc1ccccc1-c1ccccc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.53
MME P08473 1/20 0.40
ACE P12821 1/20 0.40
CPA1 P15085 1/20 0.40
ACE2 Q9BYF1 1/20 0.40
APEX1 P27695 7/20 0.38
FOLH1 Q04609 1/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
KCNA5 P22460 2/20 0.37
KCNH2 Q12809 1/20 0.37
DPP4 P27487 1/20 0.37
PDCD1 Q15116 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
PTGER1 P34995 1/20 0.36
PTGER4 P35408 1/20 0.36
PTGER3 P43115 1/20 0.36
PTGER2 P43116 1/20 0.36
AKR1C3 P42330 1/20 0.36

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
SCHEMBL3179717 1.00 KMT2A (0.53) KMT2AMMEACECPA1ACE2
SCHEMBL15732949 0.79 KMT2A (0.49) KMT2AAPEX1FOLH1DPP4PDCD1
SCHEMBL5092617 0.79 TRPA1 (0.45) KMT2APPARGPPARAAKR1C3
SCHEMBL19097598 0.79 KMT2A (0.49) KMT2AAPEX1FOLH1DPP4PDCD1
SCHEMBL16338482 0.77 ADRB2 (0.53) KMT2A
SCHEMBL865587 0.77 ADRB2 (0.53) KMT2A
SCHEMBL10015434 0.77 KMT2A (0.66) KMT2AMMEACECPA1ACE2
SCHEMBL379631 0.74 KMT2A (0.64) KMT2AMMEACECPA1ACE2
SCHEMBL13212054 0.74 KMT2A (0.58) KMT2AMMEACECPA1ACE2
SCHEMBL5088319 0.73 ALDH1A1 (0.33) KMT2AAKR1C3

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-0735062-B1 ACTINIC-RADIATION-CURABLE COMPOSITION AND LENS SHEET MITSUBISHI RAYON CO (JP) 2002-01-30 EP claimed