SCHEMBL5484868

SCHEMBL5484868

CC(=O)Cc1ccc(C)c(C(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGB1 P09429 1/20 0.44
CXCL12 P48061 1/20 0.44
CFD P00746 1/20 0.44
KLKB1 P03952 1/20 0.43
CTSB P07858 1/20 0.43
MMP9 P14780 1/20 0.43
DNMT1 P26358 1/20 0.43
DNMT3B Q9UBC3 1/20 0.43
DNMT3L Q9UJW3 1/20 0.43
DNMT3A Q9Y6K1 1/20 0.43
ALDH1A1 P00352 2/20 0.42
CDC25B P30305 1/20 0.42
CASP6 P55212 1/20 0.42
RCE1 Q9Y256 1/20 0.42
FOLH1 Q04609 1/20 0.40
LCK P06239 1/20 0.40
POLB P06746 1/20 0.40
MCL1 Q07820 1/20 0.39
HNF4A P41235 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL15177931 0.87 KDM4E (0.50) HMGB1CXCL12KLKB1CTSBMMP9
SCHEMBL11009620 0.85 NR1H4 (0.49) HMGB1CXCL12CFDKLKB1CTSB
SCHEMBL28222381 0.85 CFD (0.46) HMGB1CXCL12CFDKLKB1CTSB
SCHEMBL6859574 0.82 KLKB1 (0.62) HMGB1CXCL12CFDKLKB1CTSB
SCHEMBL29953483 0.81 KLKB1 (0.67) KLKB1CTSBMMP9DNMT1DNMT3B
SCHEMBL13652492 0.81 ALDH1A1 (0.50) HMGB1CXCL12CFDKLKB1CTSB
SCHEMBL5225010 0.81 HMGB1 (0.47) HMGB1CXCL12CFDKLKB1CTSB
SCHEMBL12900623 0.80 LMNA (0.46) ALDH1A1POLBMEN1KMT2ANR1H4
SCHEMBL19748200 0.79 HMGB1 (0.46) HMGB1CXCL12CFDKLKB1CTSB
SCHEMBL11445335 0.79 HMGB1 (0.46) HMGB1CXCL12CFDKLKB1CTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116407584-A A honeyed pill for strengthening waist and kidney and its quality detection method 江西省芙蓉堂药业股份有限公司 2023-07-11 CN claimed
CN-110806459-A Multi-medicine-flavor rapid thin-layer identification method and containing device for Erdi decoction reference substance 东阿阿胶股份有限公司 2020-02-18 CN claimed
CN-106918674-B It is a kind of treat soreness of waist and knee joint, sciatica Chinese medicine composition detection method 广州白云山陈李济药厂有限公司 2018-12-28 CN claimed
CN-106918674-A It is a kind of to treat soreness of waist and knee joint, the detection method of the Chinese medicine composition of sciatica 广州白云山陈李济药厂有限公司 2017-07-04 CN claimed
CN-102359992-B Bone-setting tablet, method thereof for identifying and measuring content TONGHUA ZHENG HE PHARMACEUTICAL CO LTD 2012-12-19 CN claimed
CN-102359992-A Bone-setting tablet, method thereof for identifying and measuring content TONGHUA ZHENG HE PHARMACEUTICAL CO LTD 2012-02-22 CN claimed
CN-101293053-A Novel preparation method for donkey-hide gelatin hematonic and quality control method HENAN NEW SIFANG PHARMACEUTICA (CN) 2008-10-29 CN claimed
CN-1321639-C Arthritis therapeutic drug SHANGHAI AMBROSIA PHARMACEUTIC (CN) 2007-06-20 CN claimed
US-20070129426-A1 Therapeutic drugs for arthritis SHANGHAI AMBROSIA PHARMACEUTICAL CO., LTD. (CN) 2007-06-07 US claimed
CN-1743843-A 18-ingredient ginseng qi-tonifying ointment quality standard detecting method SHANGHAI LEIYUNSHANG PHARMACEU (CN) 2006-03-08 CN claimed
CN-1634037-A Arthritis therapeutic drug SHANGHAI AMBROSIA PHARMACEUTIC (CN) 2005-07-06 CN claimed
CN-118330122-A Thin-layer detection method of cortex lycii radicis medicinal material or prescription granule and application of thin-layer detection method in counterfeit identification 广东一方制药有限公司 2024-07-12 CN disclosed
CN-115308352-B Quality control method of herba Aristolochiae Mollissimae sample 江阴天江药业有限公司 2023-11-10 CN disclosed
CN-116407584-A A honeyed pill for strengthening waist and kidney and its quality detection method 江西省芙蓉堂药业股份有限公司 2023-07-11 CN disclosed
CN-115308352-A Quality control method of mollissima sample 江阴天江药业有限公司 2022-11-08 CN disclosed
US-20070129426-A1 Therapeutic drugs for arthritis SHANGHAI AMBROSIA PHARMACEUTICAL CO., LTD. (CN) 2007-06-07 US disclosed
CN-1810809-A Coumarether compound and new use of its composition SHANGHAI ANPU BIOLOG SCI TECH (CN) 2006-08-02 CN disclosed
CN-1743843-A 18-ingredient ginseng qi-tonifying ointment quality standard detecting method SHANGHAI LEIYUNSHANG PHARMACEU (CN) 2006-03-08 CN disclosed
CN-1634037-A Arthritis therapeutic drug SHANGHAI AMBROSIA PHARMACEUTIC (CN) 2005-07-06 CN disclosed
US-5260335-A Tetragalloylquinic acid derivatives, gallic acid and methyl gallate PLANTAMED ARZNEIMITTEL GMBH (DE) 1993-11-09 US disclosed

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

For each of this compound's patents that has machine-readable text (1 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-20070129426-A1 Therapeutic drugs for arthritis SYVN1, CHIA, HCAR3 HMGB1 2058/4885CXCL12 2366/4885CFD 1815/4885

“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.