SCHEMBL6597885

SCHEMBL6597885

COc1ccc(CNc2nnc(N3CCC(CO)CC3)c3ccc(Cl)cc23)cc1Cl

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.84
PDE2A O00408 2/20 0.67

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
SCHEMBL6595385 0.93 PDE5A (0.81) PDE5APDE2A
Hydrochloric Acid SCHEMBL6595313 0.90 PDE5A (1.00) PDE5APDE2A
Hydrochloric Acid SCHEMBL6594538 0.88 PDE5A (1.00) PDE5APDE2A
SCHEMBL6595087 0.88 PDE5A (0.81) PDE5APDE2A
SCHEMBL27504950 0.88 PDE5A (0.85) PDE5APDE2A
SCHEMBL6593827 0.88 PDE5A (0.90) PDE5APDE2A
Hydrochloric Acid SCHEMBL6597649 0.87 PDE5A (0.85) PDE5APDE2A
SCHEMBL6773796 0.87 PDE5A (0.71) PDE5APDE2A
SCHEMBL27467175 0.86 PDE5A (0.78) PDE5APDE2A
Hydrochloric Acid SCHEMBL6595465 0.85 PDE5A (0.79) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6218392-B1 FOR THERAPY AND PROPHYLAXIS OF ISCHEMIC HEART DISEASES SUCH AS ANGINA PECTORIS, MYOCARDIAL INFARCT AND CHRONIC AND ACUTE CARDIAC FAILURE, PULMONARY HYPERTENSION, ARTERIOSCLEROSIS AND BRONCHIAL ASTHMA EISAI CO., LTD. (JP) 2001-04-17 US claimed
CN-1151136-C Condensed pyridazine compound ������������ʽ���� 2004-05-26 CN disclosed
EP-0722936-B1 FUSED PYRIDAZINE COMPOUND EISAI CO LTD (JP) 2004-05-19 EP disclosed
US-6218392-B1 FOR THERAPY AND PROPHYLAXIS OF ISCHEMIC HEART DISEASES SUCH AS ANGINA PECTORIS, MYOCARDIAL INFARCT AND CHRONIC AND ACUTE CARDIAC FAILURE, PULMONARY HYPERTENSION, ARTERIOSCLEROSIS AND BRONCHIAL ASTHMA EISAI CO., LTD. (JP) 2001-04-17 US disclosed
CN-1135210-A Fused pyridazine compound EISAI CO LTD (JP) 1996-11-06 CN disclosed
EP-0722936-A1 FUSED PYRIDAZINE COMPOUND Eisai Co., Ltd. (JP) 1996-07-24 EP disclosed