SCHEMBL28367136

SCHEMBL28367136

Nc1nn2ccc(=O)[nH]c2c1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLAT P00750 4/20 0.34
CRBN Q96SW2 3/20 0.33
HCAR1 Q9BXC0 1/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 1/20 0.33
DDB1 Q16531 1/20 0.31
MAPT P10636 2/20 0.30
TDP1 Q9NUW8 2/20 0.30
MAPK1 P28482 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
BLM P54132 1/20 0.30

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
SCHEMBL15307002 0.79 KMT2A (0.46) PLATKMT2ASMN1; SMN2L3MBTL1TSHR
SCHEMBL20694708 0.79 PLAT (0.43) PLATHCAR1MEN1KMT2ASMN1; SMN2
SCHEMBL17820828 0.78 PLAT (0.36) PLATCRBNHCAR1MEN1KMT2A
SCHEMBL21313060 0.73 PLAT (0.35) PLATCRBNHCAR1MEN1KMT2A
SCHEMBL406392 0.68 PLAT (0.46) PLATMEN1KMT2AL3MBTL1KDM4E
SCHEMBL14881615 0.67 PLAT (0.53) PLATSMN1; SMN2MAPTMAPK1KDM4E
SCHEMBL16764938 0.66 MIF (0.48) MEN1KMT2ASMN1; SMN2TSHRMAPT
SCHEMBL21313032 0.66 ALDH1A1 (0.34) SMN1; SMN2MAPTMAPK1ALDH1A1
SCHEMBL30230649 0.66 PDGFRA (0.42) SMN1; SMN2POLBTSHRMAPTKDM4E
SCHEMBL15307034 0.66 HTR6 (0.40) MEN1KMT2ASMN1; SMN2POLBL3MBTL1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116829562-A Macrocyclic compound, pharmaceutical composition and application thereof 深圳国顺康医药科技有限公司 2023-09-29 CN disclosed
CN-115884776-A Heterocyclic macrocyclic compounds and their medical use 中国医药研究开发中心有限公司 2023-03-31 CN disclosed
CN-113735881-A Macrocyclic compounds containing aminopyrazolopyrimidines, pharmaceutical compositions and uses thereof 正大天晴药业集团股份有限公司 2021-12-03 CN disclosed
CN-110945000-B Macrocyclic compounds containing aminopyrazolopyrimidines, pharmaceutical compositions and uses thereof 正大天晴药业集团股份有限公司 2021-09-03 CN disclosed
CN-109890820-B Aminopyrazolopyrimidine compounds as neurotrophin tyrosine kinase receptor inhibitors 正大天晴药业集团股份有限公司 2020-11-03 CN disclosed
CN-108003161-B Neurotrophic factor tyrosine kinase receptor inhibitors 正大天晴药业集团股份有限公司 2020-10-09 CN disclosed
CN-110945000-A Macrocyclic compounds containing aminopyrazolopyrimidines, pharmaceutical compositions and uses thereof 正大天晴药业集团股份有限公司 2020-03-31 CN disclosed