SCHEMBL9633867

SCHEMBL9633867

NC(=O)c1nsnc1C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.48
RAB9A P51151 1/20 0.48
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PDPK1 O15530 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
F2 P00734 1/20 0.33
ILK Q13418 1/20 0.31
LMNA P02545 1/20 0.30
LCK P06239 1/20 0.30
MAP2K3 P46734 1/20 0.30
MAP2K6 P52564 1/20 0.30
BTK Q06187 1/20 0.30
MAP3K19 Q56UN5 1/20 0.30
NEK10 Q6ZWH5 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL2804589 0.71 LDHA (0.46) THRBRAB9AALDH1A1KDM4EHSD17B10
SCHEMBL8951079 0.69 PDPK1 (0.48) ALDH1A1KDM4EHSD17B10PDPK1MEN1
Hydrochloric Acid SCHEMBL7529766 0.69 TDP1 (0.44) THRBRAB9AALDH1A1KDM4EHSD17B10
SCHEMBL2518142 0.67
SCHEMBL2573610 0.63
SCHEMBL9635656 0.62 KMT2A (0.39) ALDH1A1L3MBTL1PDPK1MEN1KMT2A
SCHEMBL2716679 0.61 PDPK1 (0.41) PDPK1MEN1KMT2ALMNAMAP2K3
SCHEMBL2804132 0.61 ALDH1A1 (0.44) ALDH1A1KDM4EHSD17B10L3MBTL1PDPK1
SCHEMBL11778516 0.61 PDPK1 (0.58) THRBALDH1A1KDM4EHSD17B10PDPK1
SCHEMBL1088195 0.56 MAPK1 (0.48) ALDH1A1KDM4EHSD17B10L3MBTL1PDPK1

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-5147553-A Separation of fluid mixture IONICS, INCORPORATED (US) 1992-09-15 US disclosed