SCHEMBL27468100

SCHEMBL27468100

COc1ccc(CNc2nnc(N3CCCC3CO)c3ccc(Cl)cc23)cc1Cl

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 18/20 0.70
PDE2A O00408 2/20 0.57

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
Hydrochloric Acid SCHEMBL6595463 0.99 PDE5A (0.71) PDE5APDE2A
Hydrochloric Acid SCHEMBL6595458 0.99 PDE5A (0.71) PDE5APDE2A
Hydrochloric Acid SCHEMBL6784064 0.89 PDE5A (0.75) PDE5APDE2A
SCHEMBL6597885 0.84 PDE5A (0.84) PDE5APDE2A
SCHEMBL7077526 0.82 PDE5A (0.73) PDE5APDE2A
Hydrochloric Acid SCHEMBL6595313 0.82 PDE5A (1.00) PDE5APDE2A
Hydrochloric Acid SCHEMBL6773988 0.81 PDE5A (0.74) PDE5APDE2A
SCHEMBL6595385 0.81 PDE5A (0.81) PDE5APDE2A
SCHEMBL6593827 0.81 PDE5A (0.90) PDE5APDE2A
SCHEMBL6595087 0.80 PDE5A (0.81) PDE5APDE2A

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
CN-1151136-C Condensed pyridazine compound ������������ʽ���� 2004-05-26 CN disclosed
CN-1135210-A Fused pyridazine compound EISAI CO LTD (JP) 1996-11-06 CN disclosed