SCHEMBL10472932

SCHEMBL10472932

CC(=O)Oc1ccccc1C(=O)Nc1ccc(C2=NNC(=O)CC2C)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.81
▸ MAPT P10636 1/20 0.81
▸ PDE3B Q13370 15/20 0.68
▸ PDE3A Q14432 15/20 0.68
▸ KDM4E B2RXH2 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ BLM P54132 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ TNNC1 P63316 1/20 0.48
▸ PDE4A P27815 3/20 0.46
▸ PDE4B Q07343 3/20 0.46
▸ PDE4C Q08493 3/20 0.46
▸ PDE4D Q08499 3/20 0.46
▸ GPR119 Q8TDV5 1/20 0.42

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
SCHEMBL10474361 0.88 SMN1; SMN2 (0.75) SMN1; SMN2MAPTPDE3BPDE3AKDM4E
SCHEMBL10472264 0.85 PDE3B (0.75) SMN1; SMN2MAPTPDE3BPDE3AKDM4E
SCHEMBL10472269 0.84 SMN1; SMN2 (0.76) SMN1; SMN2MAPTPDE3BPDE3AKDM4E
SCHEMBL10472837 0.83 MAPT (0.74) SMN1; SMN2MAPTPDE3BPDE3AKDM4E
SCHEMBL10472265 0.83 MAPT (0.74) SMN1; SMN2MAPTPDE3BPDE3AKDM4E
SCHEMBL10475042 0.82 PDE3B (0.67) SMN1; SMN2MAPTPDE3BPDE3AKDM4E
SCHEMBL11119840 0.80 SMN1; SMN2 (0.74) SMN1; SMN2MAPTPDE3BPDE3AKDM4E
SCHEMBL3723998 0.79 PDE3B (1.00) SMN1; SMN2MAPTPDE3BPDE3AKDM4E
SCHEMBL3723997 0.79 PDE3B (1.00) SMN1; SMN2MAPTPDE3BPDE3AKDM4E
SCHEMBL11170712 0.79 PDE3B (0.64) SMN1; SMN2MAPTPDE3BPDE3AKDM4E

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 4 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
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
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