SCHEMBL7040211

SCHEMBL7040211

O=C(Nc1ccc(OCCOCCNc2ccccn2)cc1C(=O)O)c1ccc(Cl)cc1Cl.[LiH]

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.60
PPARA Q07869 4/20 0.48
GRIK1 P39086 1/20 0.45
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
GPR27 Q9NS67 1/20 0.44
SERPINE1 P05121 1/20 0.43
ITGB1 P05556 2/20 0.42
ITGA5 P08648 2/20 0.42
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL7036839 0.91 PPARG (0.56) PPARGPPARAKMT2AMEN1GPR27
Lithium Ion SCHEMBL7040200 0.91 PPARG (0.70) PPARGPPARAKMT2AMEN1GPR27
SCHEMBL7036036 0.82 PPARG (0.81) PPARGPPARAKMT2ASERPINE1HPGD
SCHEMBL7035737 0.81 PPARG (0.83) PPARGPPARAKMT2ASERPINE1HPGD
SCHEMBL7040287 0.81 PPARG (0.70) PPARGPPARAKMT2ASERPINE1HPGD
SCHEMBL7037688 0.80 PPARG (0.63) PPARGPPARASERPINE1HPGD
SCHEMBL7041258 0.80 PPARG (0.71) PPARGPPARAKMT2ASERPINE1HPGD
SCHEMBL7035613 0.79 PPARG (0.64) PPARGPPARAGRIK1KMT2AMEN1
SCHEMBL7040599 0.79 PPARG (0.61) PPARGPPARASERPINE1
SCHEMBL7040746 0.79 PPARG (0.64) PPARGPPARASERPINE1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030073862-A1 Compounds BIOVITRUM AB (SE) 2003-04-17 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 (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 2/4885GRIK1 970/4885

“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.