SCHEMBL21940345

SCHEMBL21940345

O=C1C=Cc2ncncc2/C1=C/C=C(c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.34
CYP19A1 P11511 1/20 0.30
CYP11B2 P19099 1/20 0.30
BCAT2 O15382 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
SCHEMBL21940524 1.00 CMA1 (0.34) CMA1CYP19A1CYP11B2BCAT2
SCHEMBL363187 0.74 MEN1 (0.49) CMA1
SCHEMBL13205175 0.74 MEN1 (0.49) CMA1
SCHEMBL3373190 0.59 BCAT2 (0.47) CYP19A1CYP11B2BCAT2
SCHEMBL88322 0.58 ALDH1A1 (0.46) CYP19A1CYP11B2
SCHEMBL23392597 0.57 PTPRC (0.44)
SCHEMBL16270911 0.57 PTPRC (0.44)
SCHEMBL27888996 0.56 CYP19A1 (0.52) CYP19A1CYP11B2
SCHEMBL28141157 0.56 BCAT2 (0.43) CYP19A1CYP11B2BCAT2
SCHEMBL376723 0.55 ALDH1A1 (0.48) CYP19A1CYP11B2

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-20200131193-A1 PYRANOQUINAZOLINE DERIVATIVES AND NAPHTHOPYRAN DERIVATIVES KANTO KAGAKU KABUSHIKI KAISHA (JP) 2020-04-30 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-20200131193-A1 PYRANOQUINAZOLINE DERIVATIVES AND NAPHTHOPYRAN DERIVATIVES PPOX, TYR, NQO1 CMA1 3729/4885CYP19A1 2177/4885CYP11B2 1363/4885

“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.