SCHEMBL10472269

SCHEMBL10472269

CC1CC(=O)NN=C1c1ccc(NC(=O)c2ccccc2O)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.76
▸ MAPT P10636 1/20 0.76
▸ PDE3B Q13370 12/20 0.74
▸ PDE3A Q14432 12/20 0.74
▸ LMNA P02545 4/20 0.55
▸ KDM4E B2RXH2 3/20 0.55
▸ ALDH1A1 P00352 2/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ ALOX15 P16050 1/20 0.55
▸ TSHR P16473 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ BLM P54132 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ TNNC1 P63316 1/20 0.53
▸ TP53 P04637 2/20 0.49
▸ HTT P42858 2/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ NFKB1 P19838 1/20 0.49

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
SCHEMBL10472837 0.88 MAPT (0.74) SMN1; SMN2MAPTPDE3BPDE3ALMNA
SCHEMBL10472265 0.88 MAPT (0.74) SMN1; SMN2MAPTPDE3BPDE3ALMNA
SCHEMBL10472264 0.87 PDE3B (0.75) SMN1; SMN2MAPTPDE3BPDE3ALMNA
SCHEMBL10762953 0.86 SMN1; SMN2 (0.57) SMN1; SMN2MAPTPDE3BPDE3ALMNA
SCHEMBL10473666 0.85 PDE3B (0.62) SMN1; SMN2MAPTPDE3BPDE3ALMNA
SCHEMBL10472932 0.84 SMN1; SMN2 (0.81) SMN1; SMN2MAPTPDE3BPDE3ALMNA
SCHEMBL10473876 0.82 PDE3B (0.67) SMN1; SMN2MAPTPDE3BPDE3ALMNA
SCHEMBL10475173 0.82 PDE3B (0.70) SMN1; SMN2MAPTPDE3BPDE3ALMNA
SCHEMBL3723998 0.81 PDE3B (1.00) SMN1; SMN2MAPTPDE3BPDE3ALMNA
SCHEMBL3723997 0.81 PDE3B (1.00) SMN1; SMN2MAPTPDE3BPDE3ALMNA

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0107735-B1 NOVEL PYRIDAZINONE DERIVATIVES MITSUI TOATSU KAGAKU KABUSHIKI KAISHA (JP) 1988-10-19 — — EP claimed
US-4639451-A HYPOTENSIVE AGENTS, ANTICOAGULANTS MITSUI TOATSU KAGAKU-KABUSHIKI KAISHA (JP) 1987-01-27 — — US claimed
EP-0107735-A1 NOVEL PYRIDAZINONE DERIVATIVES MITSUI TOATSU KAGAKU KABUSHIKI KAISHA (JP) 1984-05-09 — — EP claimed
JP-58113179-A — — None — — JP disclosed
US-4965263-A HYPOTENSIVE AGENTS MITSUI TOATSU KAGAKU KABUSHIKI KAISHA (JP) 1990-10-23 — — US disclosed
EP-0107735-B1 NOVEL PYRIDAZINONE DERIVATIVES MITSUI TOATSU KAGAKU KABUSHIKI KAISHA (JP) 1988-10-19 — — EP 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
JP-S58113179-A PYRIDAZINONE DERIVATIVE MITSUI TOATSU CHEM INC 1983-07-05 — — JP disclosed
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