SCHEMBL14599798

SCHEMBL14599798

CN1CCc2c([nH]c3ccccc23)[C@H]1c1ccc2c(c1)CCO2

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 8/20 0.62
MEN1 O00255 1/20 0.59
MAPT P10636 1/20 0.59
KMT2A Q03164 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
EGFR P00533 1/20 0.52

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
SCHEMBL30539389 0.85 PDE5A (0.62) PDE5AEGFR
SCHEMBL14599799 0.85 PDE5A (0.72) PDE5A
SCHEMBL5527250 0.83 MAPT (0.75) PDE5AMEN1MAPTKMT2AL3MBTL1
SCHEMBL2508073 0.83 MAPT (0.75) PDE5AMEN1MAPTKMT2AL3MBTL1
SCHEMBL12194947 0.83 PDE5A (0.65) PDE5AMEN1MAPTKMT2AL3MBTL1
SCHEMBL29188190 0.83 ADRA1D (0.66) EGFR
SCHEMBL7419562 0.81 PDE5A (0.55) PDE5AMEN1MAPTKMT2AL3MBTL1
SCHEMBL6408309 0.80 PDE5A (0.53) PDE5AMEN1MAPTKMT2AL3MBTL1
SCHEMBL6407144 0.80 PDE5A (0.53) PDE5AMEN1MAPTKMT2AL3MBTL1
SCHEMBL6788303 0.80 PDE5A (0.53) PDE5AMEN1MAPTKMT2AL3MBTL1

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-20070015798-A1 Efficient and stereoselective process for large scale synthesis of (3R)-3-(2,3-dihydrobenzofuran-5-yl)-1,2,3,4-tetrahydropyrrolo[3,4-b]quinolin-9-one derivatives JANSSEN PHARMACEUTICA, N.V. (BE) 2007-01-18 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-20070015798-A1 Efficient and stereoselective process for large scale synthesis of (3R)-3-(2,3-dihydrobenzofuran-5-yl)-1,2,3,4-tetrahydropyrrolo[3,4-b]quinolin-9-one derivatives PDE5A, PDE3A, PDE3B PDE5A 1/4885MEN1 3866/4885MAPT 3617/4885

“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.