SCHEMBL6480716

SCHEMBL6480716

CCOC(=O)c1c[nH]c2cc(CO)sc2c1=O

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.52
GABRB2 P47870 3/20 0.52
GABRB1 P18505 2/20 0.51
GABRA3 P34903 2/20 0.51
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
CLEC4M Q9H2X3 1/20 0.45
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
ALDH1A1 P00352 2/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 3/20 0.42
MAPT P10636 2/20 0.42
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL14257469 0.83 GABRA1 (0.58) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL6479861 0.81 GABRA1 (0.51) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL28289153 0.74 GABRA1 (0.69) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL6481160 0.73 BAZ2B (0.47) CYP1A2KMT2AALDH1A1HPGDHSD17B10
SCHEMBL359436 0.72 CYP1A2 (0.56) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL1023580 0.71 CLEC4M (0.49) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL15080233 0.70 GABRA1 (0.60) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL12786969 0.70 GABRA1 (0.69) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL7164261 0.70 GABRA1 (0.63) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL5514815 0.70 GABRA1 (0.63) GABRA1GABRB2GABRB1GABRA3CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6861438-B2 Antiviral agents PFIZER (US) 2005-03-01 US disclosed
EP-1467999-A1 OXOTHIENO[3,2-B]PYRIDINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2004-10-20 EP disclosed
US-20040138449-A1 Antiviral agents PHARMACIA & UPJOHN COMPANY 2004-07-15 US disclosed
WO-2003059912-A1 OXOTHIENO (3, 2-B) PYRIDINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2003-07-24 WO 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-20040138449-A1 Antiviral agents IRF3, IFNAR1, EIF2AK2 GABRA1 4095/4885GABRB2 4384/4885GABRB1 4096/4885

“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.