SCHEMBL4467279

SCHEMBL4467279

CO/N=C(\CBr)c1ccc(F)cc1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.71
PTPN1 P18031 1/20 0.46
LMNA P02545 1/20 0.44
PTBP1 P26599 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
DRD4 P21917 8/20 0.44
DRD2 P14416 4/20 0.44
TRPA1 O75762 1/20 0.44
SLC6A4 P31645 1/20 0.42
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35

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
SCHEMBL4467283 1.00 GSK3B (0.71) GSK3BPTPN1LMNAPTBP1SMN1; SMN2
SCHEMBL6811236 0.83 TRPA1 (0.49) GSK3BLMNAPTBP1SMN1; SMN2DRD4
SCHEMBL7871655 0.83 GSK3B (0.73) GSK3BLMNADRD4DRD2SLC6A4
SCHEMBL13142483 0.83 GSK3B (0.73) GSK3BLMNAALDH1A1GAA
SCHEMBL3612594 0.83 GSK3B (0.73) GSK3BLMNAALDH1A1GAA
SCHEMBL16539522 0.81 GSK3B (0.71) GSK3BLMNASMN1; SMN2ALDH1A1GAA
SCHEMBL437419 0.81 GSK3B (0.70) GSK3BPTPN1LMNADRD4DRD2
SCHEMBL434112 0.81 GSK3B (0.70) GSK3BPTPN1LMNADRD4DRD2
SCHEMBL28778258 0.81 GSK3B (0.70) GSK3BPTPN1LMNADRD4DRD2
SCHEMBL13147671 0.79 SLC6A4 (0.47) GSK3BLMNAPTBP1SMN1; SMN2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504501-B2 Antiprotozoal imidazopyridine compounds MERIAL LIMITED (US) 2009-03-17 US disclosed
US-7504501-B2 Antiprotozoal imidazopyridine compounds MERIAL LIMITED (US) 2009-03-17 US disclosed
US-7504501-B2 Antiprotozoal imidazopyridine compounds MERIAL LIMITED (US) 2009-03-17 US disclosed
US-7429590-B2 Antiprotozoal imidazopyridine compounds MERCK & CO. INC. (US) 2008-09-30 US disclosed
US-7429590-B2 Antiprotozoal imidazopyridine compounds MERCK & CO. INC. (US) 2008-09-30 US disclosed
US-20060293303-A1 Antiprotozoal imidazopyridine compounds MERCK SHARP & DOHME LLC 2006-12-28 US disclosed
US-20060178358-A1 Antiprotozoal imidazopyridine compounds MERIAL, INC. 2006-08-10 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 (2 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-20060293303-A1 Antiprotozoal imidazopyridine compounds PNPO, PIR, PNP GSK3B 3381/4885PTPN1 596/4885LMNA 1135/4885
US-20060178358-A1 Antiprotozoal imidazopyridine compounds PNPO, PIR, TYMP GSK3B 3148/4885PTPN1 1528/4885LMNA 935/4885

“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.