SCHEMBL2071309

SCHEMBL2071309

CCC(C(=O)O)c1cccs1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.46
POLB P06746 2/20 0.45
ALOX5 P09917 1/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
KEAP1 Q14145 1/20 0.43
ALDH1A1 P00352 2/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
DAO P14920 1/20 0.39
TP53 P04637 2/20 0.39
LMNA P02545 1/20 0.39
THRB P10828 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TSHR P16473 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
GLS O94925 1/20 0.38

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
SCHEMBL3942724 0.86 CYP2C19 (0.43) CYP2C19POLBALOX5CES2CES1
SCHEMBL27347276 0.84 ALOX5 (0.42) CYP2C19POLBALOX5CES2CES1
SCHEMBL6464486 0.84 ALOX5 (0.50) CYP2C19POLBALOX5CES2CES1
SCHEMBL10210730 0.84 ALOX5 (0.50) CYP2C19POLBALOX5CES2CES1
SCHEMBL4215659 0.83 GLS (0.48) CYP2C19POLBALOX5CES2CES1
SCHEMBL14782240 0.83 ALOX5 (0.40) CYP2C19POLBALOX5CES2CES1
SCHEMBL28170178 0.83 HTT (0.45) CYP2C19POLBALOX5CES2CES1
SCHEMBL30688429 0.81 POLB (0.49) CYP2C19POLBALOX5CES2CES1
SCHEMBL3308161 0.81 ALOX5 (0.37) CYP2C19POLBALOX5CES2CES1
SCHEMBL11635124 0.81 CYP2C19 (0.46) CYP2C19POLBALOX5CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240425528-A1 AROMATIC BORON-CONTAINING COMPOUNDS AND RELATED INSULIN ANALOGS PROTOMER TECH INC (US) 2024-12-26 US disclosed
US-12139502-B2 Aromatic boron-containing compounds and related insulin analogs PROTOMER TECHNOLOGIES INC. (US) 2024-11-12 US disclosed
CN-115894434-B Preparation method of 4-piperazinyl benzothiophene hydrochloride 山东厚德精诚药业有限公司 2024-10-08 CN disclosed
US-11828741-B2 Sensor that detects an analyte in the presence of an interfering stimulus THE JOHNS HOPKINS UNIVERSITY (US) 2023-11-28 US disclosed
US-20230374045-A1 AROMATIC BORON-CONTAINING COMPOUNDS AND RELATED INSULIN ANALOGS PROTOMER TECHNOLOGIES INC. 2023-11-23 US disclosed
CN-115894434-A Preparation method of 4-piperazinyl benzothiophene hydrochloride 山东厚德精诚药业有限公司 2023-04-04 CN disclosed
EP-4041249-A1 COMPOSITIONS AND METHODS FOR IN VIVO SYNTHESIS OF UNNATURAL POLYPEPTIDES The Scripps Research Institute (US) 2022-08-17 EP disclosed
WO-2022170108-A1 PEPTIDOMIMETIC MACROCYCLES AND USES THEREOF IN PREVENTION OF RADIATION INJURY AILERON THERAPEUTICS, INC. (US) 2022-08-11 WO disclosed
US-20210156837-A1 SENSOR THAT DETECTS AN ANALYTE IN THE PRESENCE OF AN INTERFERING STIMULUS THE JOHNS HOPKINS UNIVERSITY 2021-05-27 US disclosed
US-10550143-B2 C,O-spiro aryl glycoside compounds, preparation therefor and use thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2020-02-04 US disclosed
WO-2007144140-A1 A PROCESS FOR THE PREPARATION OF POLY-ALFA-GLUTAMIC ACID AND DERIVATIVES THEREOF CELL THERAPEUTICS INC. - SEDE SECONDARIA (IT) 2007-12-21 WO disclosed
US-20070284258-A1 Method For Silver Plating DAIWA FINE CHEMICALS CO., LTD. (JP) 2007-12-13 US disclosed
US-20070072833-A1 Survivin inhibitors ABBVIE INC. 2007-03-29 US disclosed
WO-2004026848-A1 OXAZOLIDINONE DERIVATIVES, PROCESS FOR THEIR PREPERATION AND THEIR USE AS ANTIMYCOBACTERIAL AGENTS LUPIN LIMITED (IN) 2004-04-01 WO disclosed
US-6235740-B1 AUTOIMMUNE DISEASES; ANTIPROLIFERATION AGENTS BRISTOL-MYERS SQUIBB CO. 2001-05-22 US disclosed
WO-1999009845-A1 IMIDAZOQUINOXALINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-04 WO disclosed
WO-1996040732-A1 COMBINATORIAL NON-PEPTIDE LIBRARIES ZYMOGENETICS, INC. (US) 1996-12-19 WO disclosed
CN-1070645-A Imidazolyl-alkenoic acids SMITHKLINE BEECHAM CORP (US) 1993-04-07 CN disclosed
EP-0171213-A1 Spiro-imidazolones for treatment of diabetic complications PFIZER INC. (US) 1986-02-12 EP disclosed
US-3966801-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1976-06-29 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 (5 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-20070072833-A1 Survivin inhibitors XIAP, BIRC5, BIRC3 CYP2C19 4850/4885POLB 532/4885ALOX5 3523/4885
US-20240425528-A1 AROMATIC BORON-CONTAINING COMPOUNDS AND RELATED INSULIN ANALOGS IAPP, GPR119, INSR CYP2C19 3889/4885POLB 3049/4885ALOX5 4261/4885
US-10550143-B2 C,O-spiro aryl glycoside compounds, preparation therefor and use thereof SLC5A2, SLC5A1, GLP1R CYP2C19 847/4885POLB 4766/4885ALOX5 1941/4885
US-12139502-B2 Aromatic boron-containing compounds and related insulin analogs IAPP, GPR119, INSR CYP2C19 3889/4885POLB 3049/4885ALOX5 4261/4885
US-20230374045-A1 AROMATIC BORON-CONTAINING COMPOUNDS AND RELATED INSULIN ANALOGS IAPP, GPR119, INSR CYP2C19 3889/4885POLB 3049/4885ALOX5 4261/4885

“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.