SCHEMBL10079692

SCHEMBL10079692

C[C@@H](C=O)NC(=O)c1c(O)c2sc3ccccc3c2n(C)c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 5/20 0.39
ALDH1A1 P00352 4/20 0.39
HTT P42858 2/20 0.39
TP53 P04637 4/20 0.38
MAPT P10636 2/20 0.38
RXFP1 Q9HBX9 2/20 0.38
RAB9A P51151 6/20 0.37
NPC1 O15118 5/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NLRP3 Q96P20 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
POLB P06746 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
PPARG P37231 1/20 0.35

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
SCHEMBL2493420 0.86 L3MBTL1 (0.48) L3MBTL1KDM4EALDH1A1HTTTP53
SCHEMBL14034926 0.82 KMT2A (0.45) L3MBTL1KDM4EHTTMAPTRXFP1
SCHEMBL2497160 0.79 EGLN1 (0.58) KDM4ERAB9ANPC1MEN1KMT2A
SCHEMBL10079664 0.78 TP53 (0.44) L3MBTL1KDM4EALDH1A1TP53MAPT
SCHEMBL24864719 0.66 ALDH1A1 (0.40) KDM4EALDH1A1HTTTP53MAPT
SCHEMBL15419083 0.66 L3MBTL1 (0.77) L3MBTL1KDM4EALDH1A1HTTTP53
SCHEMBL12170772 0.64 MAPT (0.49) KDM4EALDH1A1HTTTP53MAPT
SCHEMBL1890099 0.64 MAPT (0.57) KDM4EALDH1A1HTTTP53MAPT
SCHEMBL2383759 0.63 L3MBTL1 (0.76) L3MBTL1KDM4EALDH1A1HTTTP53
SCHEMBL12254385 0.63 L3MBTL1 (0.72) L3MBTL1KDM4EALDH1A1HTTTP53

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-2150251-B1 THIENOPYRIDINE AND THIAZOLOPYRIDINE DERIVATIVES THAT INHIBIT PROLYL HYDROXYLASE ACTIVITY AMGEN INC (US) 2012-06-27 EP disclosed
WO-2008137060-A1 THIENOPYRIDINE AND THIAZOLOPYRIDINE DERIVATIVES THAT INHIBIT PROLYL HYDROXYLASE ACTIVITY AMGEN INC. (US) 2008-11-13 WO disclosed