SCHEMBL10473867

SCHEMBL10473867

CC1CC(=O)NN=C1c1ccc(NC(=O)c2cccs2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 8/20 0.67
▸ PDE3A Q14432 8/20 0.67
▸ SMN1; SMN2 Q16637 4/20 0.62
▸ MAPT P10636 2/20 0.62
▸ PBRM1 Q86U86 1/20 0.55
▸ ALDH1A1 P00352 4/20 0.54
▸ KDM4E B2RXH2 3/20 0.54
▸ CYP3A4 P08684 2/20 0.54
▸ CYP1A2 P05177 1/20 0.54
▸ ALOX15 P16050 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ LMNA P02545 1/20 0.54
▸ BLM P54132 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ NPC1 O15118 5/20 0.52
▸ RAB9A P51151 5/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52

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
SCHEMBL10473612 0.81 PDE3B (0.70) PDE3BPDE3ASMN1; SMN2MAPTALDH1A1
SCHEMBL10472706 0.80 PDE3B (0.66) PDE3BPDE3ASMN1; SMN2MAPTALDH1A1
SCHEMBL3723997 0.80 PDE3B (1.00) PDE3BPDE3ASMN1; SMN2MAPTALDH1A1
SCHEMBL3723998 0.80 PDE3B (1.00) PDE3BPDE3ASMN1; SMN2MAPTALDH1A1
SCHEMBL10472269 0.79 SMN1; SMN2 (0.76) PDE3BPDE3ASMN1; SMN2MAPTALDH1A1
SCHEMBL10473876 0.79 PDE3B (0.67) PDE3BPDE3ASMN1; SMN2MAPTALDH1A1
SCHEMBL10732992 0.79 PDE3B (0.70) PDE3BPDE3ASMN1; SMN2MAPTALDH1A1
SCHEMBL10475173 0.79 PDE3B (0.70) PDE3BPDE3ASMN1; SMN2MAPTALDH1A1
SCHEMBL10472151 0.78 PDE3B (0.66) PDE3BPDE3ASMN1; SMN2MAPTALDH1A1
SCHEMBL10472837 0.78 MAPT (0.74) PDE3BPDE3ASMN1; SMN2MAPTALDH1A1

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
US-4965263-A HYPOTENSIVE AGENTS MITSUI TOATSU KAGAKU KABUSHIKI KAISHA (JP) 1990-10-23 — — US disclosed
US-4639451-A HYPOTENSIVE AGENTS, ANTICOAGULANTS MITSUI TOATSU KAGAKU-KABUSHIKI KAISHA (JP) 1987-01-27 — — US disclosed
EP-0107735-A1 NOVEL PYRIDAZINONE DERIVATIVES MITSUI TOATSU KAGAKU KABUSHIKI KAISHA (JP) 1984-05-09 — — EP disclosed
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