SCHEMBL8015683

SCHEMBL8015683

OCc1ccc2ncnc(NCc3ccc4c(c3)OCO4)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 17/20 1.00
MEN1 O00255 2/20 0.76
KMT2A Q03164 2/20 0.76
ALDH1A1 P00352 1/20 0.76
SMN1; SMN2 Q16637 1/20 0.76
CLK4 Q9HAZ1 3/20 0.72

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
SCHEMBL7499068 0.87 PDE5A (1.00) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL13192079 0.86 PDE5A (0.76) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7493988 0.86 PDE5A (1.00) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL13191863 0.86 PDE5A (0.76) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL2458882 0.86 PDE5A (1.00) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL31034788 0.86 PDE5A (1.00) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL31038289 0.86 PDE5A (1.00) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL27376208 0.85 PDE5A (0.98) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL27357104 0.85 PDE5A (0.98) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL27378658 0.85 PDE5A (0.98) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6046206-A Method of treating a patient having a precancerous lesions with amide quinazoline derivatives CELL PATHWAYS, INC. (US) 2000-04-04 US disclosed
US-5801180-A ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS EISAI CO., LTD. (JP) 1998-09-01 US disclosed
US-5693652-A Benzimidazoles for ischemic heart conditions EISAI CO., LTD. (JP) 1997-12-02 US disclosed