SCHEMBL10693199

SCHEMBL10693199

CCOC(=O)SC1C(=O)N(C)C(=O)N(C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
ALDH1A1 P00352 5/20 0.39
L3MBTL1 Q9Y468 2/20 0.34
HIF1A Q16665 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
KDM4E B2RXH2 3/20 0.33
GAA P10253 2/20 0.33
GLA P06280 1/20 0.32
GSK3A P49840 2/20 0.32
GSK3B P49841 2/20 0.32
NPSR1 Q6W5P4 2/20 0.31
TSHR P16473 1/20 0.31
HPGD P15428 2/20 0.31
KDM4A O75164 1/20 0.31
USP2 O75604 1/20 0.31
POLB P06746 1/20 0.31
ALOX15 P16050 1/20 0.31
KDM4C Q9H3R0 1/20 0.31

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
SCHEMBL220343 0.73 ALDH1A1 (0.50) MAPTALDH1A1L3MBTL1HIF1AKDM4E
SCHEMBL7383358 0.63 GAA (0.41) MAPTALDH1A1L3MBTL1GAATSHR
SCHEMBL13341066 0.62 MAPT (0.36) MAPTALDH1A1CYP1A2CYP2C19KDM4E
SCHEMBL5915582 0.62 MAPT (0.61) MAPTALDH1A1L3MBTL1HIF1AKDM4E
SCHEMBL23336992 0.60 HDAC3 (0.35) MAPTL3MBTL1KDM4EGAAGLA
SCHEMBL1257489 0.60 ALDH1A1 (0.53) ALDH1A1CYP1A2GAANPSR1TSHR
SCHEMBL27879862 0.60 ALDH1A1 (0.53) ALDH1A1CYP1A2GAANPSR1TSHR
SCHEMBL15460379 0.60 MAPT (0.43) MAPTALDH1A1CYP1A2CYP2C19KDM4E
SCHEMBL7376669 0.60 GAA (0.57) MAPTALDH1A1L3MBTL1KDM4EGAA
SCHEMBL10677017 0.60 HTT (0.48) MAPTALDH1A1CYP1A2KDM4EGAA

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
US-4762830-A 5-(azolyloxyphenylcarbamoyl)barbituric acid derivatives as anthelmintics CIBA-GEIGY CORPORATION (US) 1988-08-09 US disclosed