SCHEMBL3224348

SCHEMBL3224348

CC(=O)CC(O)C(Cl)(Cl)Cl

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.58
ALDH1A1 P00352 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
LMNA P02545 2/20 0.33
PGD P52209 1/20 0.31
TRPA1 O75762 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL8382997 0.81 CYP2C19 (0.61) CYP2C19ALDH1A1TDP1
SCHEMBL4899114 0.81 CYP2C19 (0.54) CYP2C19ALDH1A1TDP1LMNAPGD
SCHEMBL6448085 0.76 ALDH1A1 (0.46) CYP2C19ALDH1A1TDP1PGDTRPA1
SCHEMBL6448088 0.76 ALDH1A1 (0.46) CYP2C19ALDH1A1TDP1PGDTRPA1
SCHEMBL11868743 0.75 CYP2C19 (0.65) CYP2C19ALDH1A1TDP1LMNA
SCHEMBL5783087 0.74 ALDH1A1 (0.43) CYP2C19ALDH1A1TDP1PGDTRPA1
SCHEMBL9574851 0.74 CYP2C19 (0.52) CYP2C19ALDH1A1TDP1LMNACYP1A2
SCHEMBL11421083 0.74 ALDH1A1 (0.43) CYP2C19ALDH1A1TDP1TRPA1
SCHEMBL11210487 0.74 ALDH1A1 (0.43) CYP2C19ALDH1A1TDP1PGDTRPA1
SCHEMBL12965457 0.74 ALDH1A1 (0.43) CYP2C19ALDH1A1TDP1PGDTRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115737695-B Pharmaceutical preparation for treating various malignant tumors, leukemia and chronic bronchitis, and preparation method and quality control method thereof 乐泰药业有限公司 2024-06-28 CN claimed
CN-115737695-A Pharmaceutical preparation for treating various malignant tumors, leukemia and chronic bronchitis, and its preparation method and quality control method 乐泰药业有限公司 2023-03-07 CN claimed
CN-115177616-B Application of streptomyces bricorubidus extract in preparation of anti-aging product 中国农业科学院农产品加工研究所 2022-11-11 CN claimed
CN-115197972-A Anti-aging streptomyces bricorubidus extract and preparation method thereof 中国农业科学院农产品加工研究所 2022-10-18 CN claimed
CN-115177616-A Application of streptomyces bricorubidus extract in preparation of anti-aging product 中国农业科学院农产品加工研究所 2022-10-14 CN claimed
CN-111217822-A Preparation method of tetrandrine as Chinese medicinal anti-allergy agent 上海浙星新型材料科技有限公司 2020-06-02 CN claimed
CN-107648369-A A kind of clarification process and method of quality control of the pharmaceutical composition that there is treatment acne to act on 广州青岚生物科技有限公司 2018-02-02 CN claimed
CN-105852033-A Plant salt containing pagodatree flower bud extracts and preparation method of plant salt 王胜 2016-08-17 CN claimed
CN-104360033-B The method of inspection of NARU SANWEI WAN 内蒙古天奇中蒙制药股份有限公司 2016-06-22 CN claimed
CN-104360033-A Quality standard of Naru three-ingredient pills and detection method of quality standard INNER MONGOLIA TIANQI CHINESE MONGOLIAN PHARMACY CO LTD 2015-02-18 CN claimed
CN-102049012-B Traditional Chinese medicine composition for treating sexual precocity of children and preparation and quality detection method thereof SHANGHAI CHILDRENS HOSPITAL 2013-01-23 CN claimed
CN-101787028-B Method for extracting galanthamine from lycoris aurea ENSHI QINGJIANG BIOENGINEERING CO LTD 2012-01-04 CN claimed
CN-102218085-A Quality control method for leaves of lithocarpus litseifolius(Hance)Chun as medicinal material CHANGZHOU SHANMEI PHARMACEUTICAL RES DEV CT CO LTD 2011-10-19 CN claimed
CN-102180851-A Method for supercritical fluid extraction of amentoflavone NANJING SORUN HERBAL TECH DEV 2011-09-14 CN claimed
CN-102078508-A Medicine for treating infantile respiratory tract recurrent infection, preparation method thereof and quality control method thereof SHANGHAI CHILDRENS HOSPITAL 2011-06-01 CN claimed
CN-102068669-A Medicament for treating infant hepatitis syndrome, and preparation method and quality control method thereof SHANGHAI CHILDRENS HOSPITAL 2011-05-25 CN claimed
CN-102049012-A Traditional Chinese medicine composition for treating sexual precocity of children and preparation and quality detection method thereof SHANGHAI CHILDRENS HOSPITAL 2011-05-11 CN claimed
CN-101926887-A Quality control method of medicinal preparation for treating gynecological inflammation and hysteromyoma GUIYANG CHUNKE PHARMACEUTICAL TECHNOLOGY RES AND DEV CO LTD 2010-12-29 CN claimed
CN-101787028-A Method for extracting galanthamine from lycoris aurea ENSHI QINGJIANG BIOENGINEERING 2010-07-28 CN claimed
CN-101485872-A A Chinese medicinal composition for treating gastropathy, and its preparation method and quality control method DALIAN MERRO PHARMACEUTICAL CO (CN) 2009-07-22 CN claimed