SCHEMBL5457547

SCHEMBL5457547

O=C(n1ccnc1)[C@@]1(c2ccncc2)C=Cc2ccccc2N1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.31
▸ MGLL Q99685 1/20 0.31

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
SCHEMBL3912413 0.70 MAPT (0.39) —
SCHEMBL4928116 0.67 MAPT (0.37) —
SCHEMBL11095601 0.64 MAPT (0.34) FAAHMGLL
Benzodiazepine SCHEMBL6424821 0.64 FAAH (0.41) FAAHMGLL
SCHEMBL10471539 0.61 NISCH (0.39) —
SCHEMBL1902569 0.60 MAPT (0.47) —
SCHEMBL7223112 0.59 GAA (0.34) —
SCHEMBL28059865 0.59 MAPT (0.43) —
SCHEMBL31448339 0.59 MAPT (0.43) —
SCHEMBL28054093 0.58 — —

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-20070191372-A1 Dna-targeted benzotriazine 1,4-dioxides and their use in cancer therapy AUCKLAND UNISERVICES LIMITED (NZ) 2007-08-16 — — 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-20070191372-A1 Dna-targeted benzotriazine 1,4-dioxides and their use in cancer therapy HIF1AN, HIF1A, HYOU1 FAAH 4158/4885MGLL 4884/4885

“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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