SCHEMBL9930143

SCHEMBL9930143

Cn1nnnc1-c1ccc(-c2cc3c(cc2F)N2C(=O)O[C@@H](Cn4ccnn4)[C@@H]2C3)cn1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAOA P21397 18/20 0.41
CYP3A4 P08684 3/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.36

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
SCHEMBL14069340 1.00 MAOA (0.41) MAOACYP3A4CYP2D6CYP2C9
SCHEMBL14069262 0.89 MAOA (0.49) MAOACYP3A4CYP2D6CYP2C9
SCHEMBL9930162 0.89 MAOA (0.49) MAOACYP3A4CYP2D6CYP2C9
SCHEMBL14069356 0.88 KCNH2 (0.34) MAOACYP3A4CYP2D6
SCHEMBL9964867 0.88 KCNH2 (0.34) MAOACYP3A4CYP2D6
SCHEMBL14069348 0.87 MAOB (0.38) MAOA
SCHEMBL9930239 0.85 MAOB (0.45) MAOA
SCHEMBL9929992 0.84 MAOA (0.43) MAOACYP3A4CYP2D6CYP2C9
SCHEMBL14069245 0.84 MAOA (0.43) MAOACYP3A4CYP2D6CYP2C9
SCHEMBL9930458 0.84 MAOB (0.36) MAOA

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 3 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
US-20120157434-A1 Antimicrobial heterocyclic compounds for treatment of bacterial infections CSO of MicuRx Pharmaceuticals, Inc. 2012-06-21 US disclosed
US-20120157434-A1 Antimicrobial heterocyclic compounds for treatment of bacterial infections CSO of MicuRx Pharmaceuticals, Inc. 2012-06-21 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-20120157434-A1 Antimicrobial heterocyclic compounds for treatment of bacterial infections NISCH, NOD1, NQO1 MAOA 1058/4885CYP3A4 140/4885CYP2D6 31/4885

“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.