SCHEMBL29138845

SCHEMBL29138845

Nc1nc2cc[c]cc2c2c1COC2

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL29138821 0.88 KDM4E (0.31) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL29138794 0.77
SCHEMBL29210747 0.77
SCHEMBL30661688 0.76 DCPS (0.46) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL29138830 0.72 KDM4E (0.32) KDM4E
SCHEMBL29138919 0.72 KDM4E (0.32) KDM4E
SCHEMBL29210749 0.72 ACHE (0.42) KDM4EALDH1A1HSD17B10
SCHEMBL30283755 0.69 ACHE (0.45) KDM4E
SCHEMBL3820902 0.68 DCPS (0.53)
SCHEMBL24468109 0.68 KDM4E (0.46) KDM4EALDH1A1GAAHPGDHSD17B10

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
CN-116888120-A PRMTS inhibitors 美国安进公司 2023-10-13 CN disclosed