SCHEMBL9523874

SCHEMBL9523874

CCn1c(=O)c(=O)[nH]c2cccnc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.57
PDE4B Q07343 3/20 0.57
PDE4C Q08493 3/20 0.57
PDE4D Q08499 3/20 0.57
PDE2A O00408 2/20 0.57
PDE6D O43924 2/20 0.57
PDE8A O60658 2/20 0.57
PDE5A O76074 2/20 0.57
PDE9A O76083 2/20 0.57
PDE8B O95263 2/20 0.57
PDE6A P16499 2/20 0.57
PDE6G P18545 2/20 0.57
PDE6B P35913 2/20 0.57
PDE6C P51160 2/20 0.57
PDE1A P54750 2/20 0.57
PDE1B Q01064 2/20 0.57
PDE3B Q13370 2/20 0.57
PDE7A Q13946 2/20 0.57
PDE6H Q13956 2/20 0.57
PDE1C Q14123 2/20 0.57

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
SCHEMBL24312042 0.84 DAO (0.58) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL5549672 0.80 PDE2A (0.58) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL7289126 0.75 PDE2A (0.53) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL29579885 0.73 CYP1A2 (0.69) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL982104 0.73 CYP1A2 (0.69) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL7269701 0.73 PDE9A (1.00) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL26671834 0.71 PDE2A (0.51) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL30809703 0.70 PDE2A (0.67) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL7329258 0.70 DAO (0.49) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL31386810 0.70 PDE2A (0.54) PDE4APDE4BPDE4CPDE4DPDE2A

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
EP-0283162-B1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1993-08-11 EP disclosed
US-4902686-A Tricyclic heterocyclic compounds and their use in treating benzodiazepin receptor-related ailments A/S FERROSAN (DK) 1990-02-20 US disclosed
US-4873244-A AILMENTS ASSOCIATED WITH BENZODIAZEPINE RECEPTORS A/S FERROSAN (DK) 1989-10-10 US disclosed
EP-0283162-A2 Heterocyclic compounds and their preparation and use NOVO NORDISK A/S (DK) 1988-09-21 EP disclosed