SCHEMBL7087032

SCHEMBL7087032

Cc1nc(-c2cccc(CN(CCc3nnn[nH]3)C(=O)Oc3ccc(-c4ccccc4S(=O)(=O)NC(C)(C)C)cc3)c2)no1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.32
PPARA Q07869 3/20 0.32
F10 P00742 2/20 0.32
GPR119 Q8TDV5 1/20 0.32
DAO P14920 1/20 0.32
ABHD6 Q9BV23 1/20 0.32
AGTR1 P30556 4/20 0.32
EDNRA P25101 4/20 0.32
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
RAB9A P51151 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31

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
SCHEMBL7087252 0.88 TP53 (0.36) PPARGPPARAF10GPR119ABHD6
SCHEMBL7089977 0.85 ALDH1A1 (0.38) PPARGPPARAF10GPR119ABHD6
SCHEMBL7094641 0.81 F10 (0.39) F10
SCHEMBL7075244 0.80 F10 (0.39) F10LMNATSHRRAB9A
SCHEMBL7087198 0.79 RAB9A (0.42) PPARGPPARADAOABHD6LMNA
SCHEMBL7098737 0.78 LMNA (0.40) AGTR1EDNRALMNARAB9A
SCHEMBL7072844 0.77 LTB4R2 (0.40) AGTR1EDNRALMNATSHRRAB9A
SCHEMBL6752250 0.75 MAPT (0.39) F10AGTR1EDNRALMNA
SCHEMBL6749855 0.73 MAPT (0.37) F10EDNRALMNATSHRRAB9A
SCHEMBL7084908 0.72 ABHD6 (0.39) PPARGPPARADAOABHD6LMNA

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-20030199698-A1 Carbamic acid esters as inhibitors of factor xa MERCK PATENT GMBH (DE) 2003-10-23 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-20030199698-A1 Carbamic acid esters as inhibitors of factor xa F11, F12, F13A1 PPARG 2910/4885PPARA 2611/4885F10 5/4885

“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.