SCHEMBL4227030

SCHEMBL4227030

Cc1cc(F)cc(NC(=O)CN2C(=O)C(c3ccc(C(F)(F)F)cc3)=NC23CCCCC3)c1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.65
HTT P42858 1/20 0.65
MAPT P10636 10/20 0.63
TP53 P04637 4/20 0.60
HPGD P15428 1/20 0.58
LMNA P02545 2/20 0.57
GAA P10253 2/20 0.57

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
SCHEMBL4221662 0.93 ALDH1A1 (0.71) ALDH1A1HTTMAPTTP53HPGD
SCHEMBL4232736 0.89 ALDH1A1 (0.69) ALDH1A1HTTMAPTTP53HPGD
SCHEMBL4223815 0.88 ALDH1A1 (0.67) ALDH1A1HTTMAPTTP53HPGD
SCHEMBL4518533 0.88 MAPT (0.76) ALDH1A1HTTMAPTTP53HPGD
SCHEMBL4224740 0.86 MAPT (0.67) ALDH1A1HTTMAPTTP53HPGD
SCHEMBL13911398 0.86 MAPT (0.76) ALDH1A1HTTMAPTTP53HPGD
SCHEMBL4234049 0.85 MAPT (0.70) ALDH1A1HTTMAPTTP53HPGD
SCHEMBL4218366 0.84 TP53 (0.60) ALDH1A1HTTMAPTTP53HPGD
SCHEMBL4228805 0.84 ALDH1A1 (0.61) ALDH1A1HTTMAPTTP53HPGD
SCHEMBL4234753 0.84 ALDH1A1 (0.61) ALDH1A1HTTMAPTTP53HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090062360-A1 Compounds Which Inhibit the Glycine Transporter and Uses Thereof GLAXO GROUP LIMITED (GB) 2009-03-05 US claimed
EP-2046795-A1 FURO[3,2-B]PYRROL-3-ONE DERIVATIVES AND THEIR USE AS CYSTEINYL PROTEINASE INHIBITORS Amura Therapeutics Limited (GB) 2009-04-15 EP disclosed
US-20090062360-A1 Compounds Which Inhibit the Glycine Transporter and Uses Thereof GLAXO GROUP LIMITED (GB) 2009-03-05 US disclosed
US-20090062360-A1 Compounds Which Inhibit the Glycine Transporter and Uses Thereof GLAXO GROUP LIMITED (GB) 2009-03-05 US disclosed
US-20090062360-A1 Compounds Which Inhibit the Glycine Transporter and Uses Thereof GLAXO GROUP LIMITED (GB) 2009-03-05 US disclosed
EP-1994010-A1 COMPOUNDS WHICH INHIBIT THE GLYCINE TRANSPORTER AND USES THEREOF GLAXO GROUP LIMITED (GB) 2008-11-26 EP disclosed
WO-2008007109-A1 FURO[3,2-B]PYRROL-3-ONE DERIVATIVES AND THEIR USE AS CYSTEINYL PROTEINASE INHIBITORS AMURA THERAPEUTICS LIMITED (GB) 2008-01-17 WO disclosed
WO-2007104775-A1 COMPOUNDS WHICH INHIBIT THE GLYCINE TRANSPORTER AND USES THEREOF GLAXO GROUP LIMITED (GB) 2007-09-20 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-20090062360-A1 Compounds Which Inhibit the Glycine Transporter and Uses Thereof SLC18A2, SLC1A2, SLC1A1 ALDH1A1 974/4885HTT 358/4885MAPT 221/4885

“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.