SCHEMBL28008362

SCHEMBL28008362

CCOc1ccc2c3c(cccc13)C(=O)N(OCC)C2=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.51
KMT2A Q03164 8/20 0.50
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 4/20 0.50
MAPT P10636 4/20 0.50
LMNA P02545 3/20 0.50
HTT P42858 2/20 0.50
POLB P06746 2/20 0.50
PABPC1 P11940 2/20 0.50
XBP1 P17861 1/20 0.50
NFKB1 P19838 1/20 0.50
SMARCA2 P51531 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
TDP1 Q9NUW8 2/20 0.47
MEN1 O00255 6/20 0.43
USP2 O75604 3/20 0.43
KEAP1 Q14145 3/20 0.43
NFE2L2 Q16236 3/20 0.43
CYP1B1 Q16678 2/20 0.43

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
SCHEMBL9437198 0.85 PRMT1 (0.70) PRMT1KMT2AALDH1A1KDM4EMAPT
SCHEMBL9437179 0.84 CYP1B1 (0.62) PRMT1KMT2AALDH1A1KDM4EMAPT
SCHEMBL11718867 0.84 PRMT1 (0.52) PRMT1KMT2AALDH1A1KDM4EMAPT
SCHEMBL11716007 0.82 PRMT1 (0.50) PRMT1KMT2AALDH1A1KDM4EMAPT
SCHEMBL9437177 0.82 KMT2A (0.57) PRMT1KMT2AALDH1A1KDM4EMAPT
SCHEMBL11717022 0.81 PRMT1 (0.47) PRMT1KMT2AALDH1A1KDM4EMAPT
SCHEMBL28064300 0.81 CYP1B1 (0.67) KMT2AALDH1A1KDM4EMAPTLMNA
SCHEMBL11712263 0.81 PRMT1 (0.49) PRMT1KMT2AALDH1A1KDM4EMAPT
SCHEMBL3770538 0.80 KMT2A (0.60) PRMT1KMT2AALDH1A1KDM4EMAPT
SCHEMBL11711661 0.79 PRMT1 (0.48) PRMT1KMT2AALDH1A1KDM4EMAPT

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-104404825-A Preparation method of thermally stable high-yield pulp yellowing inhibitor UNIV SHAANXI SCIENCE & TECH 2015-03-11 CN disclosed