SCHEMBL7268705

SCHEMBL7268705

CC1CC(=O)NN=C1c1ccc2c(N(C)C)ncnc2c1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 14/20 0.60
▸ PDE3A Q14432 14/20 0.60
▸ GALR3 O60755 2/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ PDE4A P27815 2/20 0.51
▸ PDE4B Q07343 2/20 0.51
▸ PDE4C Q08493 2/20 0.51
▸ PDE4D Q08499 2/20 0.51
▸ MAPT P10636 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ GPR119 Q8TDV5 3/20 0.46

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
SCHEMBL7276740 0.86 PDE3B (0.64) PDE3BPDE3AGALR3PDE4APDE4B
SCHEMBL7275287 0.84 PDE3B (0.62) PDE3BPDE3AGALR3PDE4APDE4B
SCHEMBL7275405 0.84 PDE3B (0.62) PDE3BPDE3AGALR3PDE4APDE4B
Hydrochloric Acid SCHEMBL7275705 0.82 PDE3B (0.60) PDE3BPDE3AGALR3PDE4APDE4B
SCHEMBL7266756 0.82 PDE3B (0.71) PDE3BPDE3AGALR3PDE4APDE4B
SCHEMBL7274472 0.82 PDE3B (0.60) PDE3BPDE3AGALR3PDE4APDE4B
SCHEMBL7276606 0.76 PDE3B (0.64) PDE3BPDE3AGALR3ALDH1A1PDE4A
SCHEMBL7273746 0.75 PDE3B (0.56) PDE3BPDE3AGALR3PDE4APDE4B
SCHEMBL6557142 0.75 PDE3B (1.00) PDE3BPDE3AGALR3ALDH1A1GPR119
SCHEMBL7267528 0.74 PDE3B (0.54) PDE3BPDE3AALDH1A1PDE4APDE4B

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
EP-0326307-B1 Novel pyridazinone derivatives and pharmaceutical preparations containing them KYOWA HAKKO KOGYO KK (JP) 1994-08-17 — — EP disclosed
US-5063227-A QUINAZOLINE-SUBSTITUTED PYRIDAZINONE DERIVATIVES HAVING CARDIOTONIC ACTIVITY KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-11-05 — — US disclosed
EP-0326307-A2 Novel pyridazinone derivatives and pharmaceutical preparations containing them KYOWA HAKKO KOGYO CO., LTD. (JP) 1989-08-02 — — EP disclosed
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