SCHEMBL7348659

SCHEMBL7348659

CCc1c2c([nH]c(=O)c1C#N)Cc1cccnc1-2

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE9A O76083 7/20 0.39
KDM4D Q6B0I6 2/20 0.39
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
POLB P06746 1/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
HSD11B1 P28845 2/20 0.35
KCNMA1 Q12791 1/20 0.34
KDM5A P29375 1/20 0.33
KDM4E B2RXH2 1/20 0.33
KMT2A Q03164 1/20 0.33
PARP1 P09874 1/20 0.32
PPARG P37231 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
NCOR2 Q9Y618 1/20 0.32

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
SCHEMBL7341062 0.69 KDM4E (0.43) ALDH1A1HPGDPDE4APDE4BPDE4C
SCHEMBL10981876 0.67 ALDH1A1 (0.39) PDE9AKDM4DALDH1A1HPGDPOLB
SCHEMBL11075425 0.66 PIM1 (0.52) PDE9AALDH1A1HPGDPOLBHSD11B1
SCHEMBL11072002 0.65 KDM4D (0.43) PDE9AKDM4DALDH1A1HPGDHSD11B1
SCHEMBL10983469 0.65 PDE9A (0.41) PDE9AALDH1A1HPGDPDE4APDE4B
SCHEMBL10985071 0.63 PDE9A (0.41) PDE9AKDM4DALDH1A1HPGDPDE4A
SCHEMBL7338198 0.63 KDM5A (0.40) PDE9AHPGDPDE4APDE4BPDE4C
SCHEMBL11092286 0.62 AURKB (0.38) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL24063428 0.61 PDE9A (0.76) PDE9AALDH1A1KCNMA1KDM4EPARP1
SCHEMBL7336559 0.61 KDM4E (0.46) ALDH1A1HPGDPDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4511569-A Tricyclic lactams and derivatives useful in increasing cardiac contractility SCHERING CORPORATION (US) 1985-04-16 US disclosed