SCHEMBL28100421

SCHEMBL28100421

COC(=O)c1cc(C(=O)O)c2cc(F)c(F)cc2n1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 6/20 0.44
PLA2G2A P14555 3/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TP53 P04637 1/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
ALOX15 P16050 1/20 0.41
POLB P06746 1/20 0.40
EIF4A1 P60842 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
ASPH Q12797 1/20 0.38
KDM8 Q8N371 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL16832948 0.91 NQO2 (0.52) NQO2PLA2G2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL16832306 0.84 ASPH (0.49) KDM4EALDH1A1HSD17B10MEN1KMT2A
SCHEMBL28602079 0.84 PLA2G2A (0.58) PLA2G2AKDM4EALDH1A1HPGDHSD17B10
SCHEMBL2905641 0.82 LCK (0.41) NQO2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL16832968 0.81 NQO2 (0.66) NQO2PLA2G2AKDM4EL3MBTL1
SCHEMBL16832671 0.81 NQO2 (0.49) NQO2PLA2G2AKDM4EALDH1A1HPGD
SCHEMBL16832636 0.80 NQO2 (0.50) NQO2KDM4EEIF4A1ASPHKDM8
SCHEMBL16832382 0.80 NQO2 (0.48) NQO2PLA2G2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL16833342 0.80 NQO2 (0.53) NQO2PLA2G2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL28100426 0.79 KDM4E (0.56) PLA2G2AKDM4EALDH1A1HPGDHSD17B10

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
CN-106029647-A Glucose transport inhibitors 拜耳制药股份公司 2016-10-12 CN disclosed