SCHEMBL5419085

SCHEMBL5419085

CC(=O)NCC1CN(c2ccc(N3CCN(C(=O)C4CCC4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.73
MAOA P21397 5/20 0.73
PTGS1 P23219 2/20 0.73
SDHA P31040 2/20 0.73
LMNA P02545 1/20 0.73
CALML3 P27482 1/20 0.73
F10 P00742 6/20 0.57
TOP2B Q02880 1/20 0.54

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
SCHEMBL14448245 1.00 MAOB (0.73) MAOBMAOAPTGS1SDHALMNA
SCHEMBL14448246 0.98 MAOB (0.73) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5411910 0.96 MAOB (0.75) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5411914 0.96 MAOB (0.75) MAOBMAOAPTGS1SDHALMNA
SCHEMBL3394745 0.89 MAOB (0.60) MAOBMAOAPTGS1SDHALMNA
SCHEMBL3397452 0.89 MAOB (0.62) MAOBMAOAPTGS1SDHALMNA
SCHEMBL3435143 0.88 MAOB (0.59) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6614867 0.88 MAOB (0.79) MAOBMAOAPTGS1SDHALMNA
SCHEMBL1894511 0.88 MAOB (0.79) MAOBMAOAPTGS1SDHALMNA
SCHEMBL3397457 0.88 MAOB (0.61) MAOBMAOAPTGS1SDHALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070167414-A1 Novel antibacterial agents ORCHID CHEMICALS & PHARMACEUTICALS LIMITED (IN) 2007-07-19 US disclosed
US-7217726-B2 Antibacterial agents ORCHID CHEMICALS & PHARMACEUTICALS LIMITED (IN) 2007-05-15 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-20070167414-A1 Novel antibacterial agents TBCD, OXA1L, ALPI MAOB 1771/4885MAOA 1590/4885PTGS1 2876/4885

“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.