SCHEMBL28292591

SCHEMBL28292591

CC(C)(O)c1ccc(OC(N)=O)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
ELANE P08246 4/20 0.37
ADAMTS4 O75173 1/20 0.35
CYP2C19 P33261 1/20 0.35
SCN9A Q15858 1/20 0.33
MAPT P10636 3/20 0.33
POLB P06746 1/20 0.33
PKM P14618 1/20 0.33
TGFBR1 P36897 1/20 0.32
ALOX5AP P20292 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
ALDH1A1 P00352 1/20 0.32
F2 P00734 1/20 0.32
GLA P06280 1/20 0.32
HPGD P15428 1/20 0.32
PARP10 Q53GL7 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
SCHEMBL29177428 0.88 KMT2A (0.40) KIF11KMT2AMEN1ELANEADAMTS4
SCHEMBL29065136 0.81 CHRNA7 (0.43) KIF11KMT2AMEN1ELANEADAMTS4
SCHEMBL4762723 0.81 KIF11 (0.51) KIF11KMT2AMEN1SCN9AMRGPRX4
SCHEMBL28940966 0.77 MEN1 (0.38) KIF11KMT2AMEN1
SCHEMBL17966038 0.77 PDE10A (0.40) CYP2C19PKMTGFBR1ALOX5APALDH1A1
SCHEMBL28292573 0.76 KIF11 (0.36) KIF11KMT2AMEN1ELANESCN9A
SCHEMBL28817265 0.75 MEN1 (0.46) KIF11KMT2AMEN1TGFBR1
SCHEMBL9413732 0.75 KMT2A (0.55) KIF11KMT2AMEN1MAPT
SCHEMBL30566578 0.75 KMT2A (0.55) KIF11KMT2AMEN1MAPT
SCHEMBL6218239 0.75 TGFBR1 (0.34) ELANECYP2C19SCN9ATGFBR1ALOX5AP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109689647-B Bicyclic heteroaryl substituted compounds 百时美施贵宝公司 2023-01-20 CN claimed
CN-117242060-A Isoindolinone compounds 蒙特罗萨医疗公司 2023-12-15 CN disclosed
CN-109689647-B Bicyclic heteroaryl substituted compounds 百时美施贵宝公司 2023-01-20 CN disclosed
CN-109689647-A The compound that bicyclic heteroaryl replaces 百时美施贵宝公司 2019-04-26 CN disclosed