SCHEMBL9937418

SCHEMBL9937418

NCc1ccnnc1CN

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AOC1 P19801 8/20 0.40
AOC3 Q16853 7/20 0.40
LOXL2 Q9Y4K0 4/20 0.39
PNMT P11086 1/20 0.30

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
SCHEMBL7116276 0.76
SCHEMBL17778292 0.74
SCHEMBL2894382 0.74
SCHEMBL2896323 0.74
SCHEMBL12988508 0.70 CYP2A6 (0.40) AOC1AOC3LOXL2
SCHEMBL2894657 0.70 AOC1 (0.40) AOC1AOC3LOXL2
SCHEMBL1416353 0.70 CD274 (0.41) AOC1AOC3LOXL2
SCHEMBL2888687 0.70 AOC1 (0.35) AOC1AOC3LOXL2
SCHEMBL9247760 0.67 LOXL2 (0.35) LOXL2
SCHEMBL2491544 0.67 DPP4 (0.47) AOC1AOC3LOXL2PNMT

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-10290819-B2 Metal complexes MERCK PATENT GMBH (DE) 2019-05-14 US disclosed
US-20130284977-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2013-10-31 US disclosed
WO-2012079741-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2012-06-21 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-10290819-B2 Metal complexes PICALM, IMMT, IKZF3 AOC1 1672/4885AOC3 2469/4885LOXL2 4583/4885

“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.