SCHEMBL28218010

SCHEMBL28218010

CC(C)(C)Nc1cccc(O)c1CO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.44
GABRA1 P14867 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
MAPT P10636 4/20 0.33
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
THRB P10828 1/20 0.33
ALOX12 P18054 1/20 0.33
TRPA1 O75762 1/20 0.33
ATM Q13315 1/20 0.33
ADRB1 P08588 1/20 0.33
CXCR2 P25025 1/20 0.33
GAA P10253 3/20 0.33
HTT P42858 3/20 0.33
TP53 P04637 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL12135848 0.76 IDO1 (0.59) IDO1MAPTALDH1A1MEN1KMT2A
SCHEMBL4551579 0.72 ALDH1A1 (0.47) GABRA1GABRG2GABRB3MAPTALDH1A1
SCHEMBL27421893 0.71 IDO1 (0.48) IDO1MAPTALDH1A1MEN1KMT2A
SCHEMBL10715140 0.71 ALDH1A1 (0.56) GABRA1GABRG2GABRB3MAPTALDH1A1
SCHEMBL10562497 0.69 MAPT (0.46) MAPTMEN1KMT2AGAAHTT
SCHEMBL6251669 0.67 IDO1 (0.52) IDO1MAPTALDH1A1KDM4EATM
SCHEMBL29881429 0.67 IDO1 (0.52) IDO1MAPTALDH1A1KDM4EATM
SCHEMBL3077796 0.67 TRPA1 (0.52) GABRA1GABRG2GABRB3MAPTALDH1A1
SCHEMBL14682131 0.67 IDO1 (0.36) IDO1MAPTALDH1A1MEN1KMT2A
SCHEMBL13884322 0.66 IDO1 (0.63) IDO1MAPTALDH1A1MEN1KMT2A

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114457622-A Moisture-proof and oxidation-resistant file box material and preparation method thereof 丁国奥 2022-05-10 CN claimed
CN-114457622-A Moisture-proof and oxidation-resistant file box material and preparation method thereof 丁国奥 2022-05-10 CN disclosed
CN-111228227-A Salbutamol sulfate oral disintegrating tablet and preparation method thereof 重庆康刻尔制药有限公司 2020-06-05 CN disclosed
CN-105456240-B Ambroxol albuterol aerosol 正大制药(青岛)有限公司 2019-06-25 CN disclosed
CN-105362226-B The preparation method of ambroxol albuterol aerosol 正大制药(青岛)有限公司 2019-06-25 CN disclosed
CN-105362246-B The preparation method of ambroxol salbutamol controlled release tablet 青岛正大海尔制药有限公司 2018-08-07 CN disclosed
CN-105326805-B The preparation method of ambroxol salbutamol dripping pill 青岛正大海尔制药有限公司 2018-06-12 CN disclosed
CN-105326804-B Ambroxol salbutamol dripping pill 青岛正大海尔制药有限公司 2018-06-05 CN disclosed
CN-105326789-B Ambroxol albuterol solution agent 青岛正大海尔制药有限公司 2018-06-05 CN disclosed
CN-105326796-B Ambroxol salbutamol powder 青岛正大海尔制药有限公司 2018-06-05 CN disclosed
CN-105362246-A Preparation method of ambroxol salbutamol controlled release tablet QINGDAO CHIA TAI HAIER PHARMACEUTICAL CO LTD 2016-03-02 CN disclosed
CN-105362226-A Preparation method of ambroxol salbutamol aerosol QINGDAO CHIA TAI HAIER PHARMACEUTICAL CO LTD 2016-03-02 CN disclosed
CN-105362234-A Ambroxol salbutamol enteric particles QINGDAO CHIA TAI HAIER PHARMACEUTICAL CO LTD 2016-03-02 CN disclosed
CN-105343040-A Preparation method of ambroxol salbutamol powder QINGDAO CHIA TAI HAIER PHARMACEUTICAL CO LTD 2016-02-24 CN disclosed
CN-105326789-A Solution containing ambroxol hydrochloride and salbutamol sulfate QINGDAO CHIA TAI HAIER PHARMACEUTICAL CO LTD 2016-02-17 CN disclosed
CN-105326804-A Dropping pills containing ambroxol hydrochloride and salbutamol sulfate QINGDAO CHIA TAI HAIER PHARMACEUTICAL CO LTD 2016-02-17 CN disclosed
CN-105326815-A Preparation method of controlled release capsules containing ambroxol hydrochloride and salbutamol sulfate QINGDAO CHIA TAI HAIER PHARMACEUTICAL CO LTD 2016-02-17 CN disclosed
CN-105326796-A Powder containing ambroxol hydrochloride and salbutamol sulfate QINGDAO CHIA TAI HAIER PHARMACEUTICAL CO LTD 2016-02-17 CN disclosed
CN-105326790-A Preparation method of solution containing ambroxol hydrochloride and salbutamol sulfate QINGDAO CHIA TAI HAIER PHARMACEUTICAL CO LTD 2016-02-17 CN disclosed
CN-105326805-A Preparation method of dropping pills containing ambroxol hydrochloride and salbutamol sulfate QINGDAO CHIA TAI HAIER PHARMACEUTICAL CO LTD 2016-02-17 CN disclosed