SCHEMBL5439904

SCHEMBL5439904

CC(=O)NCC1CN(c2ccc(N3CCN(C(=O)CNc4ccnc5cc(Cl)ccc45)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 5/20 0.57
▸ MAOB P27338 5/20 0.57
▸ PTGS1 P23219 2/20 0.57
▸ SDHA P31040 2/20 0.57
▸ LMNA P02545 1/20 0.57
▸ CALML3 P27482 1/20 0.57
▸ F10 P00742 9/20 0.53

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
SCHEMBL5439898 1.00 MAOA (0.57) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5451801 0.89 MAOA (0.57) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5451803 0.89 MAOA (0.57) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5458603 0.89 MAOA (0.65) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5458595 0.89 MAOA (0.65) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5446356 0.85 MAOB (0.59) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5446353 0.85 MAOB (0.59) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5318099 0.83 MAOB (0.58) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5318098 0.83 MAOB (0.58) MAOAMAOBPTGS1SDHALMNA
SCHEMBL21564246 0.81 MAOB (0.74) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070060558-A1 Hybrid molecules QA where Q is an aminoquinoline and A is an antibiotic residue, the synthesis and uses thereof as antibacterial agents PALUMED S.A. (FR) 2007-03-15 — — US claimed
US-20070060558-A1 Hybrid molecules QA where Q is an aminoquinoline and A is an antibiotic residue, the synthesis and uses thereof as antibacterial agents PALUMED S.A. (FR) 2007-03-15 — — 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-20070060558-A1 Hybrid molecules QA where Q is an aminoquinoline and A is an antibiotic residue, the synthesis and uses thereof as antibacterial agents QARS1, QPCT, QTRT2 MAOA 1016/4885MAOB 1323/4885PTGS1 3142/4885

“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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