SCHEMBL11984056

SCHEMBL11984056

CC(=O)NC[C@H]1CN(c2ccc(N3CCNN(C(=O)C(C)Cl)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 5/20 0.66
▸ MAOB P27338 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 10/20 0.56

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
SCHEMBL10151564 0.94 MAOA (0.67) MAOAMAOBPTGS1SDHALMNA
SCHEMBL10151459 0.90 MAOB (0.73) MAOAMAOBPTGS1SDHALMNA
SCHEMBL10151520 0.89 MAOB (0.68) MAOAMAOBPTGS1SDHALMNA
SCHEMBL10151541 0.89 MAOA (0.68) MAOAMAOBPTGS1SDHALMNA
SCHEMBL10151649 0.89 MAOB (0.70) MAOAMAOBPTGS1SDHALMNA
SCHEMBL10151511 0.89 MAOB (0.70) MAOAMAOBPTGS1SDHALMNA
SCHEMBL10151509 0.88 MAOB (0.69) MAOAMAOBPTGS1SDHALMNA
SCHEMBL10151664 0.88 MAOB (0.69) MAOAMAOBPTGS1SDHALMNA
SCHEMBL10151518 0.88 MAOB (0.69) MAOAMAOBPTGS1SDHALMNA
SCHEMBL10151595 0.88 MAOB (0.69) MAOAMAOBPTGS1SDHALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120208997-A1 NOVEL COMPOUND HAVING HETEROCYCLIC RING SUZUKI HIDEYUKI (JP) 2012-08-16 — — 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-20120208997-A1 NOVEL COMPOUND HAVING HETEROCYCLIC RING OXA1L, MRPL21, TOP1 MAOA 1563/4885MAOB 1404/4885PTGS1 1758/4885

“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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