SCHEMBL7987839

SCHEMBL7987839

COc1ccc(COc2ccc(CNc3nnc(Cl)c4cc(C#N)ccc34)cc2Cl)cc1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.79

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
SCHEMBL7914743 0.89 PDE5A (1.00) PDE5A
SCHEMBL7984756 0.87 PDE5A (0.92) PDE5A
SCHEMBL6594678 0.85 PDE5A (1.00) PDE5A
SCHEMBL7991813 0.83 PDE5A (1.00) PDE5A
SCHEMBL7983725 0.83 PDE5A (1.00) PDE5A
SCHEMBL7075756 0.81 PDE5A (0.78) PDE5A
Hydrochloric Acid SCHEMBL6774000 0.80 PDE5A (0.79) PDE5A
SCHEMBL7684803 0.79 PDE5A (0.84) PDE5A
Hydrochloric Acid SCHEMBL6594355 0.77 PDE5A (1.00) PDE5A
SCHEMBL27510101 0.77 PDE5A (0.81) PDE5A

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-6288064-B1 PHOSPHODIESTERASE INHIBITORS; PHTHALAZINE DERIVATIVES EISAI CO., LTD. (JP) 2001-09-11 US claimed
EP-0920868-A1 REMEDY FOR ERECTION FAILURE COMPRISING FUSED PYRIDAZINE COMPOUND Eisai Co., Ltd. (JP) 1999-06-09 EP claimed