SCHEMBL7040883

SCHEMBL7040883

O=C(Nc1ccc(-c2csc3ccccc23)cc1C(=O)O)c1ccc(Cl)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.55
PPARA Q07869 4/20 0.55
SERPINE1 P05121 5/20 0.53
ANO1 Q5XXA6 1/20 0.53
HDAC2 Q92769 1/20 0.52
PRSS12 P56730 2/20 0.50
F10 P00742 1/20 0.48
TP53 P04637 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL7252972 0.99 PPARG (0.54) PPARGPPARASERPINE1ANO1HDAC2
Lithium Ion SCHEMBL7252969 0.90 PPARG (0.63) PPARGPPARASERPINE1ANO1HDAC2
SCHEMBL7033000 0.89 PPARG (0.47) PPARGPPARAANO1HDAC2F10
SCHEMBL7038137 0.81 PPARG (0.68) PPARGPPARASERPINE1ANO1TP53
SCHEMBL7038130 0.81 SERPINE1 (0.70) PPARGPPARASERPINE1TP53
SCHEMBL7040866 0.80 PPARG (0.67) PPARGPPARASERPINE1ANO1TP53
SCHEMBL1307242 0.80 PPARG (0.81) PPARGPPARASERPINE1TP53ALDH1A1
SCHEMBL7040843 0.79 PPARG (0.69) PPARGPPARASERPINE1TP53
SCHEMBL7038105 0.77 PPARG (0.62) PPARGPPARASERPINE1TP53ALDH1A1
SCHEMBL1307335 0.77 GRIK1 (0.54) HDAC2PRSS12F10

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-20030073862-A1 Compounds BIOVITRUM AB (SE) 2003-04-17 US claimed
WO-2003004458-A1 NEW COMPOUNDS BIOVITRUM AB (SE) 2003-01-16 WO claimed
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 2/4885SERPINE1 1107/4885

“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.