SCHEMBL6853099

SCHEMBL6853099

CCOC(=O)C=Cc1ccc(C=CC(=O)O)c2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.51
MAPT P10636 3/20 0.51
KDM4E B2RXH2 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
ATM Q13315 1/20 0.51
PTGS2 P35354 1/20 0.49
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47

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
SCHEMBL6853096 0.94 CA12 (0.54) MAPTKDM4EMEN1KMT2AATM
SCHEMBL11218812 0.94 CA12 (0.54) MAPTKDM4EMEN1KMT2AATM
SCHEMBL6854799 0.89 KDM4E (0.53) HCAR2MAPTKDM4EMEN1KMT2A
SCHEMBL14290541 0.87 TTR (0.55) MAPTKDM4EMEN1KMT2AATM
SCHEMBL6851353 0.86 HCAR2 (0.53) HCAR2MAPTKDM4EMEN1KMT2A
SCHEMBL21449475 0.85 CA12 (0.47) MAPTKDM4EMEN1KMT2AATM
SCHEMBL12035855 0.84 CAPN1 (0.59) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL2689193 0.84 CAPN1 (0.59) MAPTKDM4EMEN1KMT2AALDH1A1
Ethyl Cinnamate SCHEMBL29527453 0.83 CA12 (0.66) HCAR2MAPTKDM4EMEN1KMT2A
SCHEMBL10783189 0.82 CA12 (0.59) HCAR2MAPTKDM4EMEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0799827-B1 ACRYLAMIDE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME KYORIN SEIYAKU KK (JP) 2004-05-12 EP disclosed
US-5786486-A ANTIMICROBIAL, ANTITUMOR AGENTS KYORIN PHARMACEUTICAL CO., LTD. (JP) 1998-07-28 US disclosed
EP-0799827-A1 ACRYLAMIDE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME KYORIN PHARMACEUTICAL CO., LTD. (JP) 1997-10-08 EP disclosed