SCHEMBL9669233

SCHEMBL9669233

COc1ccc(-c2cc3cc(C4=NNC(=O)CC4)ccc3[nH]2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 4/20 0.55
PDE3B Q13370 4/20 0.55
PDE3A Q14432 4/20 0.55
PDE4A P27815 3/20 0.55
PDE4C Q08493 3/20 0.55
PDE4D Q08499 3/20 0.55
KDM4E B2RXH2 9/20 0.50
MAPT P10636 5/20 0.50
RAB9A P51151 5/20 0.50
NPC1 O15118 4/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 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
SCHEMBL9667476 0.87 PDE3B (0.49) PDE4BPDE3BPDE3APDE4APDE4C
SCHEMBL9669040 0.85 SMN1; SMN2 (0.60) PDE4BPDE3BPDE3APDE4APDE4C
SCHEMBL9667675 0.84 KCNH2 (0.52) PDE4BPDE3BPDE3APDE4APDE4C
SCHEMBL9669024 0.84 PDE3B (0.46) PDE4BPDE3BPDE3APDE4APDE4C
SCHEMBL9668932 0.84 PDE3B (0.46) PDE4BPDE3BPDE3APDE4APDE4C
SCHEMBL10623373 0.82 PDE3B (0.66) PDE4BPDE3BPDE3APDE4APDE4C
SCHEMBL9669258 0.81 PDE3B (0.43) PDE4BPDE3BPDE3APDE4APDE4C
SCHEMBL9669379 0.81 PDE3B (0.45) PDE4BPDE3BPDE3APDE4APDE4C
SCHEMBL1375479 0.81 MAPT (0.67) PDE4BPDE3BPDE3APDE4APDE4C
SCHEMBL9667829 0.81 PDE3B (0.45) PDE4BPDE3BPDE3APDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0223937-B1 INDOLES SUBSTITUTED WITH HETEROCYCLES, INTERMEDIATES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS Roche Diagnostics GmbH (DE) 1992-03-18 EP disclosed
US-4851406-A CARDIOVASCULAR DISORDERS, HYPOTENSIVE BOEHRINGER MANNHEIM GMBH (DE) 1989-07-25 US disclosed