SCHEMBL30516230

SCHEMBL30516230

CN1CC(NC(=O)c2cc3nc(-c4ccccn4)cc(-c4ccccc4)n3n2)C1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.63
HTT P42858 3/20 0.63
ALDH1A1 P00352 6/20 0.51
HPGD P15428 6/20 0.51
NTRK1 P04629 2/20 0.49
OPRK1 P41145 2/20 0.48
PAOX Q6QHF9 2/20 0.48
ADRA2A P08913 1/20 0.48
ADRA2B P18089 1/20 0.48
HTR1D P28221 1/20 0.48
HTR1B P28222 1/20 0.48
HTR2B P41595 1/20 0.48
TMEM97 Q5BJF2 1/20 0.48
SMOX Q9NWM0 1/20 0.48
TP53 P04637 4/20 0.48
MAPT P10636 4/20 0.48
LMNA P02545 3/20 0.47
NPSR1 Q6W5P4 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
GAA P10253 1/20 0.47

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
SCHEMBL25970076 1.00 KDM4E (0.63) KDM4EHTTALDH1A1HPGDNTRK1
SCHEMBL25969941 0.92 KDM4E (0.63) KDM4EHTTALDH1A1HPGDNTRK1
SCHEMBL30516221 0.92 KDM4E (0.63) KDM4EHTTALDH1A1HPGDNTRK1
SCHEMBL25969141 0.90 KDM4E (0.77) KDM4EHTTALDH1A1HPGDOPRK1
SCHEMBL25969943 0.87 KDM4E (0.64) KDM4EHTTALDH1A1HPGDOPRK1
SCHEMBL25970078 0.85 KDM4E (0.68) KDM4EHTTALDH1A1HPGDOPRK1
SCHEMBL30516214 0.84 KDM4E (0.64) KDM4EHTTALDH1A1HPGDOPRK1
SCHEMBL25970069 0.84 KDM4E (0.62) KDM4EHTTALDH1A1HPGDNTRK1
SCHEMBL25970074 0.84 KDM4E (0.64) KDM4EHTTALDH1A1HPGDOPRK1
SCHEMBL25338396 0.82 KDM4E (0.74) KDM4EHTTALDH1A1HPGDOPRK1

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-4469454-A1 PYRAZOLOPYRIMIDINES AS MODULATORS OF SPERMINE OXIDASE Janssen Pharmaceutica NV (BE) 2024-12-04 EP disclosed
WO-2023141866-A1 PYRAZOLOPYRIMIDINES AS MODULATORS OF SPERMINE OXIDASE JANSSEN PHARMACEUTICA NV (BE) 2023-08-03 WO disclosed