SCHEMBL7150770

SCHEMBL7150770

COC(=O)c1cc(OCCOc2cccnc2SC)ccc1NC(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.55
PPARA Q07869 3/20 0.55
GAA P10253 1/20 0.45
KMT2A Q03164 1/20 0.45
TP53 P04637 1/20 0.42
ATM Q13315 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
IRAK4 Q9NWZ3 1/20 0.41

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
SCHEMBL7041215 0.92 PPARG (0.62) PPARGPPARAGAAKMT2ATP53
SCHEMBL7040706 0.91 PPARG (0.61) PPARGPPARAGAAKMT2ATP53
Lithium Ion SCHEMBL7040703 0.91 PPARG (0.69) PPARGPPARAGAAKMT2ATP53
SCHEMBL7033039 0.87 PPARG (0.58) PPARGPPARAKMT2ATP53ATM
SCHEMBL7038901 0.85 PPARG (0.56) PPARGPPARAGAAKMT2ATP53
SCHEMBL7038961 0.83 PPARG (0.55) PPARGPPARAGAAKMT2ATP53
SCHEMBL7032992 0.83 PPARG (0.55) PPARGPPARAKMT2ATP53ATM
SCHEMBL7035474 0.81 PPARG (0.80) PPARGPPARAKMT2ATP53NPC1
SCHEMBL7038360 0.80 PPARG (0.80) PPARGPPARAKMT2ATP53NPC1
SCHEMBL7033057 0.80 PPARG (0.61) PPARGPPARATP53LMNANPC1

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 2/4885GAA 1267/4885

“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.