SCHEMBL11473003

SCHEMBL11473003

CCc1nc(C(N)=O)c(O)[nH]1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 3/20 0.35
ADORA1 P30542 3/20 0.35
ADORA2A P29274 2/20 0.35
TNKS2 Q9H2K2 1/20 0.32
DDAH1 O94760 1/20 0.32
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
TYK2 P29597 1/20 0.31
JAK3 P52333 1/20 0.31
PDPK1 O15530 1/20 0.31
CDC7 O00311 1/20 0.30
PDE2A O00408 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
GAA P10253 1/20 0.30
HTT P42858 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
SCHEMBL11471657 0.85 GLA (0.36)
SCHEMBL11472946 0.82 GPR84 (0.43)
SCHEMBL13056608 0.81 CDC7 (0.36) ADORA3ADORA1ADORA2ATNKS2DDAH1
SCHEMBL11253236 0.81 ALDH1A1 (0.34) PDPK1HTT
SCHEMBL11473449 0.80 TSHR (0.38) ADORA3ADORA1ADORA2AGAA
SCHEMBL11480703 0.80 GPR84 (0.50)
SCHEMBL11269712 0.79 CYP1A2 (0.34)
SCHEMBL11267628 0.79 HSD17B10 (0.49) SMN1; SMN2HTT
SCHEMBL11262291 0.74 MEN1 (0.40) SMN1; SMN2HTT
SCHEMBL11478282 0.73 RNASEH1 (0.58) GAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-54041874-A None JP disclosed
US-4218457-A ANTICANCER ACTIVITY AND IMMUNOSTIMULATING ACTIVITY SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-08-19 US disclosed
JP-S5441874-A NOVEL 2-SUBSTITUTED IMIDAZOLE DERIVATIVE SUMITOMO CHEM CO LTD 1979-04-03 JP disclosed