SCHEMBL8697398

SCHEMBL8697398

Cc1ccc(C(c2cc3ccccc3o2)n2cncn2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 18/20 1.00
CYP26A1 O43174 2/20 0.78

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
SCHEMBL8700567 0.90 CYP26A1 (0.85) CYP19A1CYP26A1
SCHEMBL8697507 0.88 CYP19A1 (1.00) CYP19A1CYP26A1
SCHEMBL8700535 0.88 CYP19A1 (1.00) CYP19A1CYP26A1
SCHEMBL3279272 0.84 CYP19A1 (1.00) CYP19A1CYP26A1
SCHEMBL8696295 0.79 CYP19A1 (0.65) CYP19A1CYP26A1
SCHEMBL10362744 0.79 CYP19A1 (0.80) CYP19A1CYP26A1
SCHEMBL9913662 0.78 CYP19A1 (0.68) CYP19A1CYP26A1
Hydrochloric Acid SCHEMBL10540492 0.78 CYP19A1 (0.78) CYP19A1CYP26A1
SCHEMBL8697578 0.75 CYP19A1 (0.60) CYP19A1CYP26A1
SCHEMBL8697035 0.75 CYP19A1 (0.60) CYP19A1CYP26A1

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
WO-1998018791-A1 HETEROCYCLIC FURAN COMPOUNDS, THEIR PREPARATION AND USE AS AROMATASE INHIBITORS A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) 1998-05-07 WO disclosed