SCHEMBL3584058

SCHEMBL3584058

Cc1oc(-c2ccc(-c3ccc(S(C)(=O)=O)cc3)cc2)nc1CCOS(C)(=O)=O

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.45
PPARA Q07869 8/20 0.45
LMNA P02545 2/20 0.43
PPARD Q03181 1/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 2/20 0.42
TP53 P04637 2/20 0.42
HSD17B10 Q99714 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
RAB9A P51151 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
SCHEMBL3582919 0.93 PPARG (0.43) PPARGPPARALMNAPPARDPOLB
SCHEMBL6293717 0.88 PPARG (0.50) PPARGPPARALMNAPPARDPOLB
SCHEMBL3578702 0.86 PPARG (0.55) PPARGPPARAPPARDKDM4EPOLB
SCHEMBL6293798 0.86 PPARA (0.53) PPARGPPARAPPARDRAB9A
SCHEMBL6601904 0.86 HSD17B10 (0.53) PPARGPPARALMNAPOLBTP53
SCHEMBL821405 0.86 PPARG (0.59) PPARGPPARAPPARDKDM4E
SCHEMBL3590990 0.86 NPC1 (0.47) PPARGPPARALMNAKDM4EPOLB
SCHEMBL13807058 0.85 PPARG (0.48) PPARGPPARAPPARD
SCHEMBL6289729 0.85 MEN1 (0.53) PPARGPPARALMNAKDM4EPOLB
SCHEMBL6290505 0.84 PPARG (0.56) PPARGPPARAPPARDKDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7666871-B2 3-Methyl-6-(4-{5-methyl-4-[2-(2-methyl-pyrrolidin-1-yl)-ethyl]-oxazol-2-yl}-phenyl)-pyridazine; for treatment of obesity, cognitive deficiencies, narcolepsy ELI LILLY AND COMPANY (US) 2010-02-23 US disclosed
EP-1786790-B1 OXAZOLE DERIVATIVES AS HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES LILLY CO ELI (US) 2009-06-03 EP disclosed
US-20070197604-A1 Oxazole derivatives as histamine h3 receptor agents,preparation and therapeutic uses ELI LILLY AND COMPANY 2007-08-23 US disclosed
EP-1786790-A1 OXAZOLE DERIVATIVES AS HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-05-23 EP disclosed
WO-2006019833-A1 OXAZOLE DERIVATIVES AS HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2006-02-23 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-20070197604-A1 Oxazole derivatives as histamine h3 receptor agents,preparation and therapeutic uses HCRTR1, HRH3, HCRTR2 PPARG 1272/4885PPARA 1387/4885LMNA 4551/4885

“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.