SCHEMBL5949548

SCHEMBL5949548

CC(=O)NC[C@H]1CN(c2ccc(N3CCN(C(=O)C=Cc4ccc(N)cc4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 6/20 0.66
▸ MAOA P21397 5/20 0.66
▸ PTGS1 P23219 2/20 0.66
▸ SDHA P31040 2/20 0.66
▸ LMNA P02545 1/20 0.66
▸ CALML3 P27482 1/20 0.66
▸ F10 P00742 7/20 0.52

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
SCHEMBL5950128 0.94 MAOB (0.67) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5949692 0.94 MAOB (0.66) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5949833 0.93 MAOB (0.67) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5949871 0.92 MAOB (0.66) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5949620 0.92 MAOB (0.63) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5949802 0.92 MAOB (0.63) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5949467 0.92 MAOB (0.63) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5949723 0.91 MAOB (0.65) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5949890 0.91 MAOB (0.62) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5949537 0.91 MAOB (0.62) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060229316-A1 Novel antiinfective compounds, process for their preparation and pharmaceutical compositions containing them CADILA HEALTHCARE LIMITED (IN) 2006-10-12 — — US claimed
EP-1495021-A2 ANTIINFECTVE COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CADILA HEALTHCARE LTD. (IN) 2005-01-12 — — EP claimed
WO-2003082864-A2 ANTIINFECTVE COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CADILA HEALTHCARE LIMITED (IN) 2003-10-09 — — WO claimed
US-20060229316-A1 Novel antiinfective compounds, process for their preparation and pharmaceutical compositions containing them CADILA HEALTHCARE LIMITED (IN) 2006-10-12 — — US disclosed
EP-1495021-A2 ANTIINFECTVE COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CADILA HEALTHCARE LTD. (IN) 2005-01-12 — — EP disclosed
WO-2003082864-A2 ANTIINFECTVE COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CADILA HEALTHCARE LIMITED (IN) 2003-10-09 — — 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-20060229316-A1 Novel antiinfective compounds, process for their preparation and pharmaceutical compositions containing them VIP, ATG4B, ATG7 MAOB 950/4885MAOA 1053/4885PTGS1 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.

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