SCHEMBL2897779

SCHEMBL2897779

CCOC(=O)c1c(O)c2c(-c3ccc(F)cc3)csc2[nH]c1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 3/20 0.57
HTT P42858 2/20 0.47
TP53 P04637 1/20 0.47
PTPN1 P18031 1/20 0.46
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GRM6 O15303 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
MAPT P10636 2/20 0.42
PRKAB2 O43741 1/20 0.42
PRKAG1 P54619 1/20 0.42
PRKAA2 P54646 1/20 0.42
PRKAA1 Q13131 1/20 0.42
PRKAG3 Q9UGI9 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
SCHEMBL5919390 0.89 PRKCZ (0.47) PRKCZHTTTP53ALDH1A1KDM4E
SCHEMBL2897758 0.89 LMNA (0.47) PRKCZHTTTP53PTPN1ALDH1A1
SCHEMBL5919158 0.87 PRKAB2 (0.58) PRKCZHTTTP53ALDH1A1KDM4E
SCHEMBL3611853 0.83 PRKAB2 (0.47) PRKCZTP53ALDH1A1KDM4EMEN1
SCHEMBL4155315 0.80 ALDH1A1 (0.50) ALDH1A1KDM4EMAPTKDM5AKDM5B
SCHEMBL4509757 0.77 PRKCZ (0.56) PRKCZHTTTP53PTPN1ALDH1A1
SCHEMBL688813 0.74 ALDH1A1 (0.62) PRKCZTP53ALDH1A1KDM4EPOLB
SCHEMBL1189947 0.73 GSK3B (0.53) TP53PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL1191503 0.73 GSK3B (0.53) TP53PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL1189879 0.73 PRKAB2 (0.47) ALDH1A1HPGDPRKAB2PRKAG1PRKAA2

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-1879899-B1 THIENOPYRIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION LTD (GB) 2010-08-04 EP disclosed