SCHEMBL6595421

SCHEMBL6595421

COc1ccc(Cc2nnc(Cl)c3ccc(Cl)c(N)c23)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 9/20 0.47
GAA P10253 1/20 0.41
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
THRB P10828 1/20 0.39
BLM P54132 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
HSD17B10 Q99714 1/20 0.37
HPGD P15428 1/20 0.36
BCDIN3D Q7Z5W3 1/20 0.36

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
SCHEMBL27543491 0.91 PDE5A (0.45) PDE5AGAAALDH1A1SMN1; SMN2KDM4E
SCHEMBL27468605 0.86 PDE5A (0.51) PDE5AALDH1A1SMN1; SMN2
SCHEMBL27466743 0.83 PDE5A (0.46) PDE5AGAAALDH1A1KMT2AMEN1
SCHEMBL27466739 0.83 PDE5A (0.46) PDE5AGAAALDH1A1KMT2AMEN1
SCHEMBL27548033 0.82 PDE5A (0.39) PDE5AALDH1A1SMN1; SMN2KDM4ETHRB
SCHEMBL27467176 0.81 PDE4A (0.48) PDE5AHPGD
SCHEMBL27451249 0.81 PDE5A (0.51) PDE5AALDH1A1SMN1; SMN2KDM4ETHRB
SCHEMBL27466247 0.80 PDE5A (0.37) PDE5AALDH1A1SMN1; SMN2KDM4ETHRB
SCHEMBL27548037 0.78 PDE5A (0.55) PDE5A
SCHEMBL27503954 0.77 PDE5A (0.44) PDE5AGAAALDH1A1KMT2AMEN1

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
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
CN-1135210-A Fused pyridazine compound EISAI CO LTD (JP) 1996-11-06 CN disclosed