SCHEMBL25975282

SCHEMBL25975282

Cc1cc2nc(-c3ccccc3)cc(C3CCCCC3)n2n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.55
MAPK10 P53779 1/20 0.55
BTK Q06187 1/20 0.55
MRGPRX2 Q96LB1 1/20 0.55
MAPT P10636 5/20 0.47
KDM4E B2RXH2 10/20 0.46
HTT P42858 4/20 0.46
ALDH1A1 P00352 10/20 0.45
HPGD P15428 5/20 0.45
NPSR1 Q6W5P4 4/20 0.45
LMNA P02545 4/20 0.45
MAPK1 P28482 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
TP53 P04637 1/20 0.43
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
GAA P10253 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43

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
SCHEMBL25975296 0.96 MAPK8 (0.53) MAPK8MAPK10BTKMRGPRX2MAPT
SCHEMBL25975349 0.83 MAPK8 (0.51) MAPK8MAPK10BTKMRGPRX2MAPT
SCHEMBL25975317 0.82 MAPK8 (0.53) MAPK8MAPK10BTKMRGPRX2MAPT
SCHEMBL25974099 0.81 KDM4E (0.67) MAPTKDM4EHTTALDH1A1HPGD
SCHEMBL25974110 0.80 KDM4E (0.68) MAPTKDM4EHTTALDH1A1HPGD
SCHEMBL25973951 0.78 MAPK8 (0.65) MAPK8MAPK10BTKMRGPRX2MAPT
SCHEMBL25974258 0.78 MAPT (0.69) MAPK8MAPK10BTKMRGPRX2MAPT
SCHEMBL25974797 0.78 RAB9A (0.57) MAPK8MAPK10BTKMRGPRX2MAPT
SCHEMBL25974122 0.78 KDM4E (0.68) MAPTKDM4EHTTALDH1A1HPGD
SCHEMBL462683 0.77 KDM4E (0.49) MAPTKDM4EHTTALDH1A1HPGD

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
WO-2023141866-A1 PYRAZOLOPYRIMIDINES AS MODULATORS OF SPERMINE OXIDASE JANSSEN PHARMACEUTICA NV (BE) 2023-08-03 WO disclosed