SCHEMBL24284149

SCHEMBL24284149

Cc1nc2[nH]cc(C)c2nc1CO

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32

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
SCHEMBL23229336 0.78 MAPT (0.33) —
SCHEMBL14144943 0.72 MAPK1 (0.31) ALDH1A1
SCHEMBL24284153 0.70 — —
SCHEMBL2110629 0.68 KDM4E (0.42) KDM4EALDH1A1
SCHEMBL24284141 0.64 MAPK1 (0.32) KDM4EALDH1A1
SCHEMBL29870786 0.64 KDM4E (0.39) KDM4EALDH1A1
SCHEMBL2684164 0.64 KDM4E (0.39) KDM4EALDH1A1
SCHEMBL29792794 0.64 KDM4E (0.39) KDM4EALDH1A1
Ammonia Solution, Strong SCHEMBL28316942 0.62 KDM4E (0.38) KDM4EALDH1A1
SCHEMBL24284139 0.62 CCNB2 (0.34) KDM4E

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-2022042331-A1 HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2022-03-03 — — WO disclosed
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