SCHEMBL23701809

SCHEMBL23701809

NC/C(=C\F)COc1ccc(-c2cnc[nH]2)cc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 17/20 0.59
AOC2 O75106 3/20 0.56
MAOA P21397 3/20 0.56
MAOB P27338 3/20 0.56
DAO P14920 2/20 0.56

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
SCHEMBL23701754 0.81 AOC3 (0.61) AOC3AOC2MAOAMAOBDAO
SCHEMBL23701753 0.81 AOC3 (0.61) AOC3AOC2MAOAMAOBDAO
SCHEMBL23718609 0.78 AOC3 (0.64) AOC3AOC2MAOAMAOBDAO
Hydrochloric Acid SCHEMBL23701841 0.77 AOC3 (0.62) AOC3AOC2MAOAMAOBDAO
SCHEMBL20714309 0.75 AOC3 (0.64) AOC3AOC2MAOAMAOBDAO
SCHEMBL20714060 0.75 AOC3 (0.64) AOC3AOC2MAOAMAOBDAO
SCHEMBL23718739 0.75 AOC2 (0.81) AOC3AOC2MAOAMAOBDAO
SCHEMBL23718741 0.75 AOC2 (0.81) AOC3AOC2MAOAMAOBDAO
Hydrochloric Acid SCHEMBL29037068 0.74 AOC3 (0.62) AOC3AOC2MAOAMAOBDAO
Hydrochloric Acid SCHEMBL29037073 0.74 AOC3 (0.62) AOC3AOC2MAOAMAOBDAO

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-20210238192-A1 VASCULAR ADHESION PROTEIN-1 (VAP-1) MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPEUTICS, INC. 2021-08-05 US disclosed
US-20210238192-A1 VASCULAR ADHESION PROTEIN-1 (VAP-1) MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPEUTICS, INC. 2021-08-05 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-20210238192-A1 VASCULAR ADHESION PROTEIN-1 (VAP-1) MODULATORS AND THERAPEUTIC USES THEREOF VCAM1, VAPB, ICAM1 AOC3 796/4885AOC2 807/4885MAOA 2312/4885

“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.