SCHEMBL9347102

SCHEMBL9347102

COC(=O)C(C#N)=Cc1ccc(O)c(O)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.72
EGFR P00533 15/20 0.68
ERBB2 P04626 5/20 0.66
KDM4E B2RXH2 3/20 0.66
MEN1 O00255 3/20 0.66
ALDH1A1 P00352 3/20 0.66
TP53 P04637 3/20 0.66
MAPT P10636 3/20 0.66
HPGD P15428 3/20 0.66
KMT2A Q03164 3/20 0.66
HSD17B10 Q99714 3/20 0.66
TDP1 Q9NUW8 3/20 0.66
CYP1A2 P05177 2/20 0.66
LCK P06239 1/20 0.66
LMNA P02545 2/20 0.62
POLB P06746 2/20 0.62
CYP3A4 P08684 2/20 0.62
ALOX15 P16050 2/20 0.62
ALOX12 P18054 2/20 0.62
MAPK1 P28482 2/20 0.62

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
SCHEMBL9347097 1.00 DNM1 (0.72) DNM1EGFRERBB2KDM4EMEN1
SCHEMBL10241955 0.88 ALDH1A1 (0.60) DNM1EGFRERBB2KDM4EMEN1
SCHEMBL6874673 0.87 MEN1 (0.77) EGFRMEN1ALDH1A1MAPTKMT2A
SCHEMBL6874677 0.87 MEN1 (0.77) EGFRMEN1ALDH1A1MAPTKMT2A
SCHEMBL21457243 0.86 DNM1 (0.54) DNM1EGFRERBB2KDM4EMEN1
SCHEMBL131205 0.86 DNM1 (0.54) DNM1EGFRERBB2KDM4EMEN1
SCHEMBL21457407 0.86 DNM1 (0.54) DNM1EGFRERBB2KDM4EMEN1
SCHEMBL21457405 0.86 DNM1 (0.54) DNM1EGFRERBB2KDM4EMEN1
SCHEMBL10413552 0.85 KDM4E (0.59) EGFRKDM4EALDH1A1MAPTHPGD
SCHEMBL10413551 0.85 KDM4E (0.59) EGFRKDM4EALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3081746-A None JP disclosed
EP-3553097-B1 COPOLYMER AND OPTICAL FILM USING SAME TOSOH CORP (JP) 2022-05-04 EP disclosed
US-11225540-B2 Copolymer and optical film using same TOSOH CORPORATION (JP) 2022-01-18 US disclosed
US-20200095358-A1 COPOLYMER AND OPTICAL FILM USING SAME TOSOH CORPORATION (JP) 2020-03-26 US disclosed
EP-3553097-A1 COPOLYMER AND OPTICAL FILM USING SAME Tosoh Corporation (JP) 2019-10-16 EP disclosed
EP-0339671-B1 Derivative of caffeic acid and pharmaceutical composition containing the same SUNTORY LTD (JP) 1994-08-10 EP disclosed
US-5063243-A Arteriosclerosis treatment SUNTORY, LTD. (JP) 1991-11-05 US disclosed
JP-H0381746-A ORGANIC NONLINEAR OPTICAL MATERIAL SEKISUI CHEM CO LTD 1991-04-08 JP disclosed