SCHEMBL29985806

SCHEMBL29985806

Cc1c(C(=O)O)cc2cc(-c3ccnn3C)cn2c1C(C)N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EED O75530 13/20 0.51
RBBP4 Q09028 13/20 0.51
SUZ12 Q15022 13/20 0.51
EZH2 Q15910 13/20 0.51
AEBP2 Q6ZN18 13/20 0.51
TBK1 Q9UHD2 6/20 0.47

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
SCHEMBL21113133 0.91 EED (0.49) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21157348 0.85 EED (0.65) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL28958911 0.84 EED (0.54) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21240625 0.84 EED (0.57) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL29986331 0.83 TBK1 (0.40) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21113362 0.83 TBK1 (0.42) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL19964730 0.83 EED (0.53) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21113182 0.82 EED (0.48) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21113310 0.81 EED (0.68) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21113258 0.79 EED (0.56) EEDRBBP4SUZ12EZH2AEBP2

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-109790160-B Pyrido five-membered aromatic ring compound, preparation method and application thereof 上海海和药物研究开发股份有限公司 2022-11-15 CN disclosed