SCHEMBL25974258

SCHEMBL25974258

Cc1cc2nc(-c3ccccc3)cc(-c3ccccc3)n2n1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.69
ALDH1A1 P00352 10/20 0.64
KDM4E B2RXH2 10/20 0.64
MAPK1 P28482 3/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
HPGD P15428 8/20 0.54
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
HTT P42858 5/20 0.52
LMNA P02545 3/20 0.52
NPSR1 Q6W5P4 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
GAA P10253 3/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
HSD17B10 Q99714 2/20 0.51
MAPK8 P45983 1/20 0.51

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
SCHEMBL25975177 0.93 MAPT (0.61) MAPTALDH1A1KDM4EMAPK1MEN1
SCHEMBL25975056 0.93 MAPT (0.61) MAPTALDH1A1KDM4EMAPK1MEN1
SCHEMBL25975025 0.92 MAPT (0.59) MAPTALDH1A1KDM4EMAPK1MEN1
SCHEMBL25975238 0.88 MAPT (0.56) MAPTALDH1A1KDM4EMAPK1HPGD
SCHEMBL25975072 0.88 MAPT (0.56) MAPTALDH1A1KDM4EMAPK1MEN1
SCHEMBL25974911 0.87 MAPT (0.55) MAPTALDH1A1KDM4EMAPK1MEN1
SCHEMBL13541890 0.86 MAPT (0.55) MAPTALDH1A1KDM4EMAPK1MEN1
SCHEMBL25975097 0.86 NPC1 (0.57) MAPTALDH1A1KDM4EMAPK1MEN1
SCHEMBL25975420 0.85 KDM4E (0.69) MAPTALDH1A1KDM4EMAPK1MEN1
SCHEMBL25975137 0.84 MAPT (0.51) MAPTALDH1A1KDM4EMAPK1MEN1

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