SCHEMBL9747711

SCHEMBL9747711

CCOC(=O)Cn1c(=O)oc(=O)c2ccc(F)cc21

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
GAA P10253 2/20 0.53
PKM P14618 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
HK1 P19367 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HKDC1 Q2TB90 1/20 0.48
KDM4E B2RXH2 1/20 0.45
RAB9A P51151 1/20 0.45
TP53 P04637 2/20 0.45
CCR3 P51677 1/20 0.44
CBX7 O95931 3/20 0.43
CDYL2 Q8N8U2 3/20 0.43
CDYL Q9Y232 3/20 0.43
CDY1; CDY1B Q9Y6F8 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL9744272 0.84 ALDH1A1 (0.43) ALDH1A1GAAPKMMEN1KMT2A
SCHEMBL3456759 0.82 KDM4E (0.62) ALDH1A1MEN1KMT2AKDM4ERAB9A
SCHEMBL9744646 0.81 LMNA (0.44) ALDH1A1GAAPKMMEN1KMT2A
SCHEMBL11999983 0.78 KDM4E (0.54) ALDH1A1GAAPKMMEN1KMT2A
SCHEMBL14498505 0.76 ALDH1A1 (0.46) ALDH1A1GAAPKMMEN1KMT2A
SCHEMBL21027556 0.74 ALDH1A1 (0.44) ALDH1A1GAAPKMMEN1KMT2A
SCHEMBL14498510 0.72 TSHR (0.45) ALDH1A1GAAMEN1KMT2AKDM4E
SCHEMBL4714240 0.72 TSHR (0.51) ALDH1A1GAAPKMMEN1KMT2A
SCHEMBL14498499 0.72 ALDH1A1 (0.45) ALDH1A1GAAPKMMEN1KMT2A
SCHEMBL6740743 0.72 PER2 (0.40) ALDH1A1KMT2ARAB9ACBX7CDYL2

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
US-7235566-B2 Pyridinone derivatives for treatment of atherosclerosis SMITHKLINE BEECHAM P.L.C. (GB) 2007-06-26 US disclosed
US-7235566-B2 Pyridinone derivatives for treatment of atherosclerosis SMITHKLINE BEECHAM P.L.C. (GB) 2007-06-26 US disclosed
US-5093364-A 5-FLUOROANTHRANILIC FUNGICIDES SCHERING AGROCHEMICALS LIMITED (GB) 1992-03-03 US disclosed