SCHEMBL459076

SCHEMBL459076

Cc1ncc(OC(N)=O)cn1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MEN1 O00255 1/20 0.43
KIF11 P52732 1/20 0.35
NNMT P40261 4/20 0.34
SIRT6 Q8N6T7 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 2/20 0.31
ALDH1A1 P00352 1/20 0.31
F2 P00734 1/20 0.31
GLA P06280 1/20 0.31
HPGD P15428 1/20 0.31
CTNNB1 P35222 1/20 0.31
GRM4 Q14833 1/20 0.31

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
SCHEMBL29225190 0.80 KMT2A (0.45) KMT2AMEN1KIF11NNMTSIRT6
SCHEMBL24786404 0.80 LMNA (0.50) KMT2AMEN1SMN1; SMN2MAPTALDH1A1
SCHEMBL185620 0.80 LMNA (0.35) KMT2AMEN1MAPTALOX15ALDH1A1
SCHEMBL28940910 0.79 ALDH1A1 (0.52) KMT2AMEN1KIF11SIRT6SMN1; SMN2
SCHEMBL15881098 0.79 KMT2A (0.41) KMT2AMEN1KIF11NNMTSIRT6
SCHEMBL28998209 0.78 MEN1 (0.43) KMT2AMEN1KIF11NNMTSMN1; SMN2
SCHEMBL28724684 0.78 MEN1 (0.43) KMT2AMEN1KIF11NNMTSIRT6
SCHEMBL28816899 0.78 KMT2A (0.43) KMT2AMEN1KIF11NNMTSIRT6
SCHEMBL9413732 0.78 KMT2A (0.55) KMT2AMEN1KIF11MAPT
SCHEMBL28882879 0.78 MEN1 (0.39) KMT2AMEN1KIF11NNMTSIRT6

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 11 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-109689664-B Tricyclic heteroaryl substituted quinoline and azaquinoline compounds as PAR4 inhibitors 百时美施贵宝公司 2022-04-15 CN claimed
CN-109689647-B Bicyclic heteroaryl substituted compounds 百时美施贵宝公司 2023-01-20 CN disclosed
CN-115279765-A 1H-pyrazolo [4,3-d ] pyrimidine compounds as Toll-like receptor 7 (TLR 7) agonists 百时美施贵宝公司 2022-11-01 CN disclosed
CN-115210236-A 1H-pyrazolo [4,3-d ] pyrimidine compounds as Toll-like receptor 7 (TLR 7) agonists 百时美施贵宝公司 2022-10-18 CN disclosed
CN-115210235-A 1H-pyrazolo [4,3-d ] pyrimidine compounds as Toll-like receptor 7 (TLR 7) agonists 百时美施贵宝公司 2022-10-18 CN disclosed
CN-115151546-A C3-substituted 1H-pyrazolo [4,3-d ] pyrimidine compounds as Toll-like receptor 7 (TLR 7) agonists 百时美施贵宝公司 2022-10-04 CN disclosed
CN-115151547-A 1H-pyrazolo [4,3-d ] pyrimidine compounds as Toll-like receptor 7 (TLR 7) agonists 百时美施贵宝公司 2022-10-04 CN disclosed
CN-115151548-A 1H-pyrazolo [4,3-d ] pyrimidine compounds as Toll-like receptor 7 (TLR 7) agonists 百时美施贵宝公司 2022-10-04 CN disclosed
CN-109689664-B Tricyclic heteroaryl substituted quinoline and azaquinoline compounds as PAR4 inhibitors 百时美施贵宝公司 2022-04-15 CN disclosed
WO-2012010578-A1 SUBSTITUTED METHYL-PYRIMIDIN-5-YL CARBAMATES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-01-26 WO disclosed