SCHEMBL1992532

SCHEMBL1992532

CCCCN1c2ccccc2N(C)C1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.45
ALDH1A1 P00352 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CDC25A P30304 10/20 0.39
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
PDF Q9HBH1 1/20 0.39
KDM4E B2RXH2 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
CCKBR P32239 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
SCHEMBL28979065 0.95 CDC25A (0.44) MEN1KMT2APOLBALDH1A1CDC25A
SCHEMBL28979310 0.94 CDC25A (0.46) MEN1KMT2APOLBCDC25APDF
SCHEMBL28283751 0.94 CDC25A (0.46) MEN1KMT2APOLBCDC25APDF
SCHEMBL28979323 0.94 CDC25A (0.46) MEN1KMT2APOLBCDC25APDF
SCHEMBL28979082 0.94 CDC25A (0.46) MEN1KMT2APOLBCDC25APDF
SCHEMBL28979096 0.94 CDC25A (0.46) MEN1KMT2APOLBCDC25APDF
SCHEMBL28283868 0.90 MTNR1A (0.40) MEN1KMT2APOLBALDH1A1CDC25A
SCHEMBL28979084 0.85 CASP1 (0.37) MEN1KMT2APOLBCDC25AGAA
SCHEMBL28733597 0.80 MEN1 (0.36) MEN1KMT2APOLBALDH1A1TP53
SCHEMBL28979322 0.79 BRD4 (0.50) MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110475765-B Preparation method of amide compound 广荣化学株式会社 2023-04-07 CN disclosed
CN-110475765-A The preparation method of amides compound KOEI CHEMICAL CO 2019-11-19 CN disclosed
EP-2392606-B1 PREPARATION METHOD OF POLYLACTIC ACID BY CATALYSIS OF CARBENE DERIVATIVES NANJING UNIVERSITY OF TECHNOLOGY (CN) 2018-03-28 EP disclosed
US-9029497-B2 Method of making polylactic acid using carbene derivatives as the catalyst NANJING UNIVERSITY OF TECHNOLOGY (CN) 2015-05-12 US disclosed
US-20110152493-A1 METHOD OF MAKING POLYLACTIC ACID USING CARBENE DERIVATIVES AS THE CATALYST NANJING UNIVERSITY OF TECHNOLOGY 2011-06-23 US disclosed