SCHEMBL7039682

SCHEMBL7039682

COC(=O)c1cc(OCCSc2ccccc2)ccc1NC(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.63
PPARA Q07869 4/20 0.63
TP53 P04637 3/20 0.48
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL7040905 0.91 PPARG (0.63) PPARGPPARATP53MAPTNPC1
SCHEMBL7038701 0.90 PPARG (0.62) PPARGPPARATP53MAPTNPC1
Lithium Ion SCHEMBL7038699 0.89 PPARG (0.77) PPARGPPARATP53MAPT
SCHEMBL7033057 0.88 PPARG (0.61) PPARGPPARATP53MAPTSMN1; SMN2
SCHEMBL7035474 0.88 PPARG (0.80) PPARGPPARATP53MAPTSMN1; SMN2
SCHEMBL7034610 0.85 PPARG (0.61) PPARGPPARATP53MAPTSMN1; SMN2
SCHEMBL7040738 0.85 TP53 (0.58) PPARGPPARATP53MAPTSMN1; SMN2
SCHEMBL7038901 0.83 PPARG (0.56) PPARGPPARATP53MAPTSMN1; SMN2
SCHEMBL7033039 0.82 PPARG (0.58) PPARGPPARATP53MAPTSMN1; SMN2
SCHEMBL7032992 0.82 PPARG (0.55) PPARGPPARATP53MAPTSMN1; SMN2

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-20030073862-A1 Compounds BIOVITRUM AB (SE) 2003-04-17 US disclosed
WO-2003004458-A1 NEW COMPOUNDS BIOVITRUM AB (SE) 2003-01-16 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-20030073862-A1 Compounds PPARG, PPARA, PPARD PPARG 1/4885PPARA 2/4885TP53 2763/4885

“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.