SCHEMBL26136200

SCHEMBL26136200

COc1cc(N)ccc1OCc1cccnn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.51
MAPT P10636 2/20 0.51
KDM4E B2RXH2 2/20 0.51
SYK P43405 5/20 0.50
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.41
TRPM5 Q9NZQ8 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
EGFR P00533 1/20 0.40
ERBB2 P04626 1/20 0.40
CYP19A1 P11511 2/20 0.38
KDM4C Q9H3R0 1/20 0.38
TP53 P04637 1/20 0.37
CSF1R P07333 1/20 0.37
RET P07949 1/20 0.37
KDR P35968 1/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
NR4A1 P22736 1/20 0.37

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
SCHEMBL30354819 1.00 GAA (0.51) GAAMAPTKDM4ESYKALDH1A1
SCHEMBL30354949 0.84 SYK (0.45) KDM4ESYKALDH1A1TRPM5EGFR
SCHEMBL30354925 0.84 SYK (0.69) GAAMAPTKDM4ESYKHTT
SCHEMBL1406302 0.84 SYK (0.69) GAAMAPTKDM4ESYKHTT
SCHEMBL21835398 0.82 SYK (0.55) MAPTSYKEGFRERBB2CYP19A1
SCHEMBL29944984 0.82 SYK (0.55) MAPTSYKEGFRERBB2CYP19A1
SCHEMBL1225050 0.80 FDPS (0.57) MAPTALDH1A1TSHRTRPM5HTT
SCHEMBL30354876 0.78 SMN1; SMN2 (0.46) MAPTKDM4EALDH1A1HTTCYP19A1
SCHEMBL29151272 0.78 SMN1; SMN2 (0.46) MAPTKDM4EALDH1A1HTTCYP19A1
SCHEMBL30354815 0.78 GAA (0.58) GAAMAPTKDM4ESYKALDH1A1

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
EP-4169916-A1 CARBONOHYDRAZONOYL DICYANIDE COMPOUND INCLUDING AT LEAST TWO TYPES OF ARYL OR HETEROARYL LINKED BY NOVEL LINKER, AND USE THEREOF Korea Institute of Science and Technology (KR) 2023-04-26 EP disclosed