SCHEMBL11169646

SCHEMBL11169646

CCOCCSC(=O)Nc1ccc(C2=NNC(=O)CC2C)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 14/20 0.66
▸ PDE3A Q14432 14/20 0.66
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ MAPT P10636 1/20 0.53
▸ KDM4E B2RXH2 2/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ BLM P54132 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ TNNC1 P63316 1/20 0.48
▸ HRH3 Q9Y5N1 2/20 0.44
▸ PDE4A P27815 3/20 0.44
▸ PDE4B Q07343 3/20 0.44
▸ PDE4C Q08493 3/20 0.44
▸ PDE4D Q08499 3/20 0.44

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
SCHEMBL11169980 0.90 PDE3B (0.64) PDE3BPDE3ASMN1; SMN2MAPTKDM4E
SCHEMBL11163881 0.89 PDE3B (0.67) PDE3BPDE3ASMN1; SMN2MAPTKDM4E
SCHEMBL11170907 0.87 PDE3B (0.65) PDE3BPDE3ASMN1; SMN2MAPTKDM4E
SCHEMBL11162011 0.86 PDE3B (0.67) PDE3BPDE3ASMN1; SMN2MAPTKDM4E
SCHEMBL11165225 0.86 PDE3B (0.70) PDE3BPDE3ASMN1; SMN2MAPTKDM4E
SCHEMBL11167445 0.85 PDE3B (0.66) PDE3BPDE3ASMN1; SMN2MAPTKDM4E
SCHEMBL11170187 0.85 PDE3B (0.66) PDE3BPDE3ASMN1; SMN2MAPTKDM4E
SCHEMBL11165273 0.84 PDE3B (0.82) PDE3BPDE3ASMN1; SMN2MAPTKDM4E
SCHEMBL11157732 0.84 PDE3B (0.64) PDE3BPDE3ASMN1; SMN2MAPTKDM4E
SCHEMBL11162754 0.83 PDE3B (0.62) PDE3BPDE3ASMN1; SMN2MAPTKDM4E

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-4415571-A HYPOTENSIVE AGENTS; THROMBOSIS; ANTICOAGULANTS; CARDIOVASCULAR DISORDDERS BASF AKTIENGESELLSCHAFT (DE) 1983-11-15 — — US disclosed
EP-0042513-A1 Dihydropyridazinones, processes for their preparation and pharmaceutical compositions containing these compounds BASF Aktiengesellschaft (DE) 1981-12-30 — — EP disclosed
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