SCHEMBL5651917

SCHEMBL5651917

CCOC(=O)c1sc2c(ccc(=O)n2-c2ccccc2[N+](=O)[O-])c1-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
AR P10275 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
GAA P10253 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
SLC5A1 P13866 1/20 0.39
SLC5A2 P31639 1/20 0.39
MAPT P10636 4/20 0.39
RAB9A P51151 3/20 0.39
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CDC7 O00311 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
DBF4 Q9UBU7 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GRM6 O15303 1/20 0.37

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
SCHEMBL2952888 0.87 ALDH1A1 (0.40) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL5648156 0.86 FBP1 (0.42) ALDH1A1GAAMAPTTDP1CYP1A2
SCHEMBL5652104 0.84 ALDH1A1 (0.53) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL5651787 0.84 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL5652682 0.84 FBP1 (0.38) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL5650136 0.83 MAPT (0.51) ALDH1A1ARMEN1KMT2ASMN1; SMN2
SCHEMBL5652446 0.82 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL5650867 0.80 MAPT (0.47) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL5652595 0.79 MAPT (0.45) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL5652764 0.79 MAPT (0.45) ALDH1A1MEN1KMT2ASMN1; SMN2GAA

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
US-7176215-B2 Bicyclic oxopyridine and oxopyrimidine derivatives CELLTECH R&D LIMITED (GB) 2007-02-13 US disclosed
US-20040254200-A1 Bicyclic oxopyridine and oxopyrimidine derivatives UCB PHARMA S.A. (BE) 2004-12-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040254200-A1 Bicyclic oxopyridine and oxopyrimidine derivatives MAPK1, ALK, NAT1 ALDH1A1 1498/4885AR 1083/4885MEN1 4697/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.