SCHEMBL4499424

SCHEMBL4499424

COc1cccc2c(NC(=O)/C(C#N)=C(\C)O)c(C(C)=O)oc12

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 15/20 0.45
MAOA P21397 1/20 0.39
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
LMNA P02545 1/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL4499430 1.00 DHODH (0.45) DHODHMAOAPDE4APDE4BPDE4C
SCHEMBL4499414 1.00 DHODH (0.45) DHODHMAOAPDE4APDE4BPDE4C
SCHEMBL4514984 0.86 CYSLTR2 (0.43) DHODHLMNA
SCHEMBL4514987 0.86 CYSLTR2 (0.43) DHODHLMNA
SCHEMBL4514989 0.86 CYSLTR2 (0.43) DHODHLMNA
SCHEMBL4502463 0.81 TSHR (0.48) MAOALMNARECQL
SCHEMBL4496239 0.79 ALDH1A1 (0.51) DHODHLMNA
SCHEMBL4496234 0.79 ALDH1A1 (0.51) DHODHLMNA
SCHEMBL4496227 0.79 ALDH1A1 (0.51) DHODHLMNA
SCHEMBL4507435 0.76 NPSR1 (0.47) MAOALMNARECQL

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-7638540-B2 Benzofuran compound and medicinal composition containing the same THE NEW INDUSTRY RESEARCH ORGANIZATION (JP) 2009-12-29 US disclosed
US-20060194851-A1 Benzofuran compound and medicinal composition containing the same NEW INDUSTRY RESEARCH ORGANIZATION, THE (JP) 2006-08-31 US disclosed
EP-1627873-A1 BENZOFURAN COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME The New Industry Research Organization (JP) 2006-02-22 EP 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-20060194851-A1 Benzofuran compound and medicinal composition containing the same LTB4R2, LTC4S, LTB4R DHODH 789/4885MAOA 2570/4885PDE4A 2659/4885

“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.