SCHEMBL5837649

SCHEMBL5837649

O=C1C=CN(c2ccc(N3CC(CNC(=S)C(F)F)OC3=O)cc2F)CC1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.53
MAOA P21397 3/20 0.53
LMNA P02545 1/20 0.53
PTGS1 P23219 1/20 0.53
CALML3 P27482 1/20 0.53
SDHA P31040 1/20 0.53
F10 P00742 13/20 0.51

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
SCHEMBL5839054 0.90 MAOB (0.56) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5838375 0.90 F10 (0.47) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5838147 0.88 CYP2E1 (0.49) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5838128 0.87 MAOB (0.58) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5838360 0.87 MAOB (0.54) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5837798 0.86 MAOA (0.70) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5839315 0.86 MAOB (0.55) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5839469 0.85 MAOB (0.58) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5837869 0.85 MAOB (0.71) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5839127 0.85 MAOB (0.58) MAOBMAOALMNAPTGS1CALML3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7105547-B2 Antimicrobial 1-aryl dihydropyridone compounds PHARMACIA AND UPJOHN COMPANY (US) 2006-09-12 US claimed
US-20050070580-A1 Antimicrobial 1-aryl dihydropyridone compounds GORDEEV MIKHAIL FEDOR (US) 2005-03-31 US claimed
US-7105547-B2 Antimicrobial 1-aryl dihydropyridone compounds PHARMACIA AND UPJOHN COMPANY (US) 2006-09-12 US disclosed
US-20050070580-A1 Antimicrobial 1-aryl dihydropyridone compounds GORDEEV MIKHAIL FEDOR (US) 2005-03-31 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-20050070580-A1 Antimicrobial 1-aryl dihydropyridone compounds TLR1, QDPR, AP1S1 MAOB 3414/4885MAOA 3032/4885LMNA 4798/4885

“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.