SCHEMBL10474308

SCHEMBL10474308

CC(O)C(=O)Nc1ccc(C2=NNC(=O)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.54
PDE3B Q13370 12/20 0.53
SMN1; SMN2 Q16637 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
MAPT P10636 2/20 0.49
KMT2A Q03164 1/20 0.49
PDE3A Q14432 11/20 0.48
PDE4A P27815 5/20 0.48
PDE4B Q07343 5/20 0.48
PDE4C Q08493 5/20 0.48
PDE4D Q08499 5/20 0.48
LMNA P02545 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
CYP2C19 P33261 1/20 0.48

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
SCHEMBL11192353 0.88 KCNH2 (0.53) KCNH2PDE3BSMN1; SMN2NPC1RAB9A
SCHEMBL10472724 0.88 KCNH2 (0.53) KCNH2PDE3BSMN1; SMN2NPC1RAB9A
SCHEMBL10999826 0.87 KCNH2 (0.55) KCNH2PDE3BSMN1; SMN2NPC1RAB9A
SCHEMBL10992462 0.86 KCNH2 (0.51) KCNH2PDE3BSMN1; SMN2NPC1RAB9A
SCHEMBL10990539 0.86 PDE3B (0.53) KCNH2PDE3BSMN1; SMN2NPC1RAB9A
SCHEMBL10474310 0.86 PDE3B (0.53) KCNH2PDE3BSMN1; SMN2NPC1RAB9A
SCHEMBL10990884 0.86 KCNH2 (0.51) KCNH2PDE3BSMN1; SMN2NPC1RAB9A
SCHEMBL11479531 0.85 KCNH2 (0.56) KCNH2PDE3BSMN1; SMN2NPC1RAB9A
SCHEMBL11487896 0.85 KCNH2 (0.56) KCNH2PDE3BSMN1; SMN2NPC1RAB9A
SCHEMBL10474613 0.85 PDE3B (0.52) KCNH2PDE3BSMN1; SMN2NPC1RAB9A

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 5 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
US-4544562-A 6-Aryl-4,5-dihydro-3(2H)-pyridazinones, and their use as anti-hypertensive and anti-thrombocyte agents BASF AKTIENGESELLSCHAFT (DE) 1985-10-01 US disclosed
EP-0107735-A1 NOVEL PYRIDAZINONE DERIVATIVES MITSUI TOATSU KAGAKU KABUSHIKI KAISHA (JP) 1984-05-09 EP disclosed
EP-0089528-A1 6-Aryl-4,5-dihydro-3(2H)-pyridazinones, their preparation and use BASF Aktiengesellschaft (DE) 1983-09-28 EP disclosed