SCHEMBL2547046

SCHEMBL2547046

CC(=O)OB(OC(C)=O)OC(C)=O.[KH]

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
TSHR P16473 3/20 0.41
LMNA P02545 3/20 0.33
HSD17B10 Q99714 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
THPO P40225 1/20 0.31
FFAR3 O14843 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 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
SCHEMBL6319 0.96 ALDH1A1 (0.44) ALDH1A1TSHRLMNAHSD17B10TDP1
SCHEMBL28578939 0.93 ALDH1A1 (0.41) ALDH1A1TSHRLMNAHSD17B10TDP1
SCHEMBL269725 0.93 ALDH1A1 (0.41) ALDH1A1TSHRLMNAHSD17B10TDP1
SCHEMBL1528 0.93 ALDH1A1 (0.41) ALDH1A1TSHRLMNAHSD17B10TDP1
SCHEMBL19518538 0.93 ALDH1A1 (0.41) ALDH1A1TSHRLMNAHSD17B10TDP1
SCHEMBL31146798 0.93 ALDH1A1 (0.41) ALDH1A1TSHRLMNAHSD17B10TDP1
Ammonia Solution, Strong SCHEMBL18860444 0.93 ALDH1A1 (0.41) ALDH1A1TSHRLMNAHSD17B10TDP1
SCHEMBL23121571 0.90 ALDH1A1 (0.39) ALDH1A1TSHRLMNAHSD17B10TDP1
SCHEMBL22472309 0.90 ALDH1A1 (0.39) ALDH1A1TSHRLMNAHSD17B10TDP1
Hydrochloric Acid SCHEMBL2000729 0.90 ALDH1A1 (0.39) ALDH1A1TSHRLMNAHSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115677465-B Preparation method of beta-cyclic citral 新发药业有限公司 2024-09-10 CN claimed
CN-116660454-A Method for detecting triacetoxyborohydride content 四川青木制药有限公司 2023-08-29 CN claimed
EP-3766869-B1 SIMPLE PREPARATION METHOD FOR AVIBACTAM XINFA PHARMACEUTICAL CO LTD (CN) 2023-05-10 EP claimed
CN-116063186-A Process and intermediates for the preparation of (S) -2-amino-5, 7-difluoro-1, 2,3, 4-tetrahydronaphthalene hydrogen halides 江苏亚虹医药科技股份有限公司 2023-05-05 CN claimed
CN-115677465-A Preparation method of beta-cyclocitral 新发药业有限公司 2023-02-03 CN claimed
CN-110734424-B Preparation method of vonoprazan fumarate 四川弘远药业有限公司 2022-12-13 CN claimed
CN-115232113-A Process for the preparation of 5R- (((tetrahydro-2H-pyran-2-yl) oxy) amino) piperidine-2S-carboxylic acid ester salts 山东致泰医药技术有限公司 2022-10-25 CN claimed
CN-113429380-B Preparation method of duloxetine 新发药业有限公司 2022-07-01 CN claimed
EP-3733648-B1 METHOD FOR PREPARING 5R-BENZYLOXYAMINOPIPERIDIN-2S-CARBOXYLIC ACID OR DERIVATIVE THEREOF XINFA PHARMACEUTICAL CO LTD (CN) 2022-06-08 EP claimed
US-11208417-B2 Simple process for preparing avibactam XINFA PHARMACEUTICAL CO., LTD (CN) 2021-12-28 US claimed
CN-110734424-A preparation method of vonoprazan fumarate 成都弘达药业有限公司 2020-01-31 CN claimed
EP-3546451-A1 IMPROVED METHOD FOR PREPARATION OF 5R Xinfa Pharmaceutical Co., Ltd (CN) 2019-10-02 EP claimed
US-20190256514-A1 Process for Preparing 5R-[(benzyloxy) amino] piperidine-2S-carboxylate and Oxalates Thereof XINFA PHARMACEUTICAL CO., LTD (CN) 2019-08-22 US claimed
US-20160168138-A1 PROCESS FOR THE PREPARATION OF SUVOREXANT AND INTERMEDIATES USEFUL IN THE SYNTHESIS OF SUVOREXANT REDDY S LAB LIMTED DR (IN) 2016-06-16 US claimed
EP-3021851-A2 PROCESS FOR THE PREPARATION OF SUVOREXANT AND INTERMEDIATES USEFUL IN THE SYNTHESIS OF SUVOREXANT Dr. Reddy's Laboratories Ltd. (IN) 2016-05-25 EP claimed
US-8183376-B2 Stereoselective reduction of a morphinone NEKTAR THERAPEUTICS (US) 2012-05-22 US claimed
US-7374690-B2 Processes for removing oil from solid wellbore materials and produced water HALLIBURTON ENERGY SERVICES, INC. (US) 2008-05-20 US claimed
US-20070125714-A1 PROCESSES FOR REMOVING OIL FROM SOLID WELLBORE MATERIALS AND PRODUCED WATER HALLIBURTON ENERGY SERVICES, INC. (US) 2007-06-07 US claimed
US-7192527-B2 Processes for removing oil from solid wellbore materials and produced water HALLIBURTON ENERGY SERVICES, INC. (US) 2007-03-20 US claimed
US-20060032820-A1 Processes for removing oil from solid wellbore materials and produced water HALLIBURTON ENERGY SERVICES, INC. 2006-02-16 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11208417-B2 Simple process for preparing avibactam PGLS, CPS1, BPGM ALDH1A1 1829/4885TSHR 2530/4885LMNA 4534/4885
US-20190256514-A1 Process for Preparing 5R-[(benzyloxy) amino] piperidine-2S-carboxylate and Oxalates Thereof OTC, CA1, GLUL ALDH1A1 328/4885TSHR 3935/4885LMNA 3102/4885
US-20160168138-A1 PROCESS FOR THE PREPARATION OF SUVOREXANT AND INTERMEDIATES USEFUL IN THE SYNTHESIS OF SUVOREXANT KMO, HCRTR2, COMT ALDH1A1 1864/4885TSHR 1303/4885LMNA 2754/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.