SCHEMBL9930263

SCHEMBL9930263

Cn1cc2c(n1)CN(c1cc3c(cc1F)N1C(=O)O[C@@H](COc4cnsn4)[C@@H]1C3)C2

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL14069344 1.00 MAOA (0.32) MAOAMAOBCYP2C19
SCHEMBL9930432 0.86 MAOA (0.31) MAOAMAOBCYP2C19
SCHEMBL9968479 0.85 MAOA (0.37) MAOAMAOBCYP2C19
SCHEMBL9930455 0.83 MAOA (0.37) MAOAMAOBCYP2C19
SCHEMBL14069346 0.80 MAOA (0.31) MAOAMAOBCYP2C19
SCHEMBL9968478 0.79 MAOA (0.43) MAOAMAOBCYP2C19
SCHEMBL9930565 0.79 MAOA (0.52) MAOAMAOBCYP2C19
SCHEMBL14069343 0.79 MAOA (0.52) MAOAMAOBCYP2C19
SCHEMBL14069345 0.78 MAOA (0.38) MAOAMAOBCYP2C19
SCHEMBL9930843 0.78 MAOA (0.35) MAOAMAOBCYP2C19

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-20120157434-A1 Antimicrobial heterocyclic compounds for treatment of bacterial infections CSO of MicuRx Pharmaceuticals, Inc. 2012-06-21 US disclosed
WO-2008108988-A1 ANTIMICROBIAL HETEROCYCLIC COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS MICURX PHARMACEUTICALS, INC. (US) 2008-09-12 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-20120157434-A1 Antimicrobial heterocyclic compounds for treatment of bacterial infections NISCH, NOD1, NQO1 MAOA 1058/4885MAOB 761/4885CYP2C19 47/4885

“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.