SCHEMBL28306459

SCHEMBL28306459

O=[SH](=O)Cc1nc(-c2cccc(O)c2)cc(C(F)(F)F)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SDHB P21912 5/20 0.41
HSD17B10 Q99714 3/20 0.40
KDM4E B2RXH2 1/20 0.40
SYK P43405 1/20 0.39
LMNA P02545 2/20 0.39
POLB P06746 2/20 0.39
HSD17B1 P14061 1/20 0.39
HSD17B2 P37059 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
S1PR4 O95977 1/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
S1PR1 P21453 1/20 0.39
MAPK1 P28482 1/20 0.39
STAT3 P40763 1/20 0.39
STAT1 P42224 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL28306273 0.86 NT5E (0.43) SDHBHSD17B10KDM4ELMNAPOLB
SCHEMBL28874911 0.85 HSD17B10 (0.55) SDHBHSD17B10KDM4ELMNAPOLB
SCHEMBL28874912 0.85 SDHB (0.58) SDHBHSD17B10KDM4ELMNAPOLB
SCHEMBL28306393 0.84 SYK (0.46) SDHBHSD17B10KDM4ESYKMEN1
SCHEMBL28306266 0.81 ALPL (0.45) SDHBHSD17B10KDM4ESYK
SCHEMBL28306355 0.81 SDHB (0.63) SDHBHSD17B10KDM4ESYKLMNA
SCHEMBL28307459 0.81 SDHB (0.60) SDHBHSD17B10KDM4ELMNAPOLB
SCHEMBL28307443 0.81 KDM4E (0.49) SDHBHSD17B10KDM4ELMNAPOLB
SCHEMBL28306275 0.79 MAPT (0.47) SDHBHSD17B10KDM4ESYKTP53
SCHEMBL28307430 0.79 KDM4E (0.56) HSD17B10KDM4ELMNAKMT2ATP53

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-110023292-A Apoptosis inhibitor 北京生命科学研究所 2019-07-16 CN disclosed