SCHEMBL534682

SCHEMBL534682

CCOC(=O)C=Cc1ccnc(OC)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.59
MAOB P27338 1/20 0.58
TTR P02766 1/20 0.56
DPP4 P27487 1/20 0.56
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
CYP3A4 P08684 1/20 0.50
ACHE P22303 4/20 0.48
BCHE P06276 3/20 0.48
P2RY12 Q9H244 1/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
ALOX5 P09917 2/20 0.44
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44

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
SCHEMBL9106504 0.85 TTR (0.54) FDPSTTRCA12CA1CA2
SCHEMBL9106499 0.85 TTR (0.54) FDPSTTRCA12CA1CA2
SCHEMBL21633159 0.84 TTR (0.60) FDPSMAOBTTRDPP4CA12
SCHEMBL21633161 0.84 TTR (0.60) FDPSMAOBTTRDPP4CA12
SCHEMBL5849920 0.82 TTR (0.57) FDPSMAOBTTRDPP4CA12
SCHEMBL3553948 0.82 TTR (0.57) FDPSMAOBTTRDPP4CA12
SCHEMBL3553947 0.82 TTR (0.57) FDPSMAOBTTRDPP4CA12
SCHEMBL5849917 0.82 TTR (0.57) FDPSMAOBTTRDPP4CA12
SCHEMBL11309003 0.81 TTR (0.56) FDPSMAOBTTRDPP4CA12
SCHEMBL20153362 0.80 FDPS (0.61) FDPSMAOBTTRDPP4CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120035214-A1 RENIN INHIBITORS MERCK CANADA INC. (CA) 2012-02-09 US disclosed
EP-2413941-A1 RENIN INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-02-08 EP disclosed
WO-2010114978-A1 RENIN INHIBITORS MERCK SHARP & DOHME CORP. (US) 2010-10-07 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-20120035214-A1 RENIN INHIBITORS REN, ACE, AGTR1 FDPS 3330/4885MAOB 1712/4885TTR 1996/4885

“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.