SCHEMBL11246313

SCHEMBL11246313

COCc1cc(CO)oc1CN(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.40
KDM4E B2RXH2 4/20 0.40
POLB P06746 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 2/20 0.32
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
GAA P10253 2/20 0.32
THRB P10828 1/20 0.32
G6PD P11413 1/20 0.32
PABPC1 P11940 1/20 0.32
HKDC1 Q2TB90 1/20 0.32
MAOB P27338 4/20 0.32
DAO P14920 1/20 0.32
PRKCE Q02156 2/20 0.32
MYLK Q15746 2/20 0.32
PRKCG P05129 1/20 0.32
PRKCA P17252 1/20 0.32
APEX1 P27695 1/20 0.32

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
SCHEMBL11260097 0.76 PRMT6 (0.52)
SCHEMBL11248627 0.74 KDM4E (0.41) TDP1KDM4EPOLBL3MBTL1ALDH1A1
SCHEMBL11260053 0.73 KDM4E (0.41) TDP1KDM4EPOLBL3MBTL1ALDH1A1
SCHEMBL11248268 0.70 GSR (0.43) TDP1KDM4EPOLBL3MBTL1ALDH1A1
SCHEMBL11256940 0.69 GLA (0.43) TDP1KDM4EPOLBL3MBTL1ALDH1A1
SCHEMBL11254687 0.66 PRMT6 (0.55) APEX1
SCHEMBL11245023 0.66 TUBB4A (0.32)
SCHEMBL183000 0.64 KDM4E (0.37) TDP1KDM4EPOLBL3MBTL1ALDH1A1
SCHEMBL23656263 0.63 LMNA (0.39) TDP1KDM4EPOLBL3MBTL1ALDH1A1
SCHEMBL10955573 0.63 ACHE (0.36) TDP1KDM4EPOLBL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0001699-B1 DERIVATIVES OF FURYL COMPOUNDS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLAXO GROUP LIMITED (GB) 1982-02-24 EP disclosed
US-4288443-A HISTAMINE ANTAGONISTS GLAXO GROUP LIMITED (GB) 1981-09-08 US disclosed