SCHEMBL65179

SCHEMBL65179

CN1CCN(Cc2ccc(C(=O)O)cc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.69
MC4R P32245 1/20 0.62
HRH3 Q9Y5N1 2/20 0.61
LMNA P02545 2/20 0.59
CHKA P35790 5/20 0.58
GAA P10253 2/20 0.56
THRB P10828 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
HDAC1 Q13547 3/20 0.54
HDAC4 P56524 2/20 0.54
BTK Q06187 1/20 0.54
HDAC3 O15379 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC10 Q969S8 1/20 0.54
HDAC11 Q96DB2 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC9 Q9UKV0 1/20 0.54
HDAC5 Q9UQL6 1/20 0.54
KCNH2 Q12809 1/20 0.54

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
SCHEMBL16356429 1.00 HDAC6 (0.69) HDAC6MC4RHRH3LMNACHKA
Hydrochloric Acid SCHEMBL14763998 0.98 HDAC6 (0.68) HDAC6MC4RHRH3LMNACHKA
Hydrochloric Acid SCHEMBL3272318 0.98 HDAC6 (0.68) HDAC6MC4RHRH3LMNACHKA
Hydrochloric Acid SCHEMBL846616 0.98 HDAC6 (0.68) HDAC6MC4RHRH3LMNACHKA
Hydrochloric Acid SCHEMBL3664891 0.97 HDAC6 (0.66) HDAC6MC4RHRH3LMNACHKA
Hydrochloric Acid SCHEMBL1583152 0.97 HDAC6 (0.66) HDAC6MC4RHRH3LMNACHKA
Hydrogen Sulfide SCHEMBL27950422 0.94 HDAC6 (0.62) HDAC6MC4RHRH3LMNACHKA
Hydrochloric Acid SCHEMBL14763461 0.92 HDAC6 (0.61) HDAC6MC4RHRH3LMNACHKA
SCHEMBL10074441 0.91 HDAC1 (0.62) HDAC6HRH3LMNAGAATHRB
SCHEMBL15149927 0.90 HDAC6 (0.58) HDAC6MC4RHRH3LMNACHKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115850258-B Synthesis method of masitinib 东北林业大学 2024-09-24 CN claimed
CN-115850258-A Synthesis method of masitinib 东北林业大学 2023-03-28 CN claimed
CN-114685428-A Preparation method of imatinib mesylate 重庆圣华曦药业股份有限公司 2022-07-01 CN claimed
EP-3431478-B1 MICROMOLECULAR LUNG-TARGETING DRUG YAOPHARMA CO LTD (CN) 2021-11-17 EP claimed
US-10463743-B2 Amphiphilic drug-drug conjugates for cancer therapy, compositions and methods of preparation and uses thereof SHANGHAI JIAO TONG UNIVERSITY (CN) 2019-11-05 US claimed
EP-3403651-B1 ISOCORYDINE DERIVATIVES, PREPARATION METHOD AND USE THEREOF LANZHOU INST CHEMICAL PHYSICS CAS (CN) 2019-10-30 EP claimed
US-20190029997-A1 SMALL MOLECULAR LUNG-TARGETING DRUG YAOPHARMA CO., LTD. (CN) 2019-01-31 US claimed
EP-3431478-A1 MICROMOLECULAR LUNG-TARGETING DRUG Yaopharma Co., Ltd. (CN) 2019-01-23 EP claimed
US-20180334448-A1 Isocorydine derivatives, preparation method and use thereof LANZHOU INSTITUTE OF CHEMICAL PHYSICS, CHINESE ACADEMY OF SCIENCES (CN) 2018-11-22 US claimed
EP-3403651-A1 ISOCORYDINE DERIVATIVES, PREPARATION METHOD AND USE THEREOF Lanzhou Institute Of Chemical Physics Chinese Academy of Sciences (CN) 2018-11-21 EP claimed
EP-1313703-B1 PRODRUGS TO NMDA RECEPTOR LIGANDS HOFFMANN LA ROCHE (CH) 2008-02-13 EP claimed
CN-1227230-C Prodrugs to NMDA receptor ligands HOFFMANN LA ROCHE (CH) 2005-11-16 CN claimed
CN-1447793-A Prodrugs to NMDA receptor ligands HOFFMANN LA ROCHE (CH) 2003-10-08 CN claimed
EP-1313703-A1 PRODRUGS TO NMDA RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2003-05-28 EP claimed
US-6407235-B1 A NMDA (N-METHYL-D-ASPARTATE)-RECEPTOR-SUBTYPE SELECTIVE BLOCKERS; PRODRUGS HAVE IMPROVED SOLUBILITY AND ARE HYDROLYZED IN VIVO; FOR EXAMPLE, THE 4-AMINOMETHYL-BENZOIC ACID ESTER OF THE PHENOL, OR THE PHOSPHATE ESTER HOFFMANN-LA ROCHE INC. 2002-06-18 US claimed
US-20020040037-A1 Prodrug acid esters of [2-(4-benzyl-3-hydroxy-piperidin-1-yl)-ethansulfonyl]phenol EVOTEC INTERNATIONAL GMBH (DE) 2002-04-04 US claimed
WO-2002016321-A1 PRODRUGS TO NMDA RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2002-02-28 WO claimed
US-5675023-A VISION DEFECTS; NERVOUS SYSTEM DISORDERS; COMPLICATIONS OF DIABETES TSUMURA & CO. (JP) 1997-10-07 US claimed
US-5627204-A ENZYME INHIBITORS FOR TREATMENT OF DIABETES TSUMURA & COMPANY (JP) 1997-05-06 US claimed
US-5455267-A For reducing side effects of diabetes TSUMURA & CO. (JP) 1995-10-03 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 (4 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-20020040037-A1 Prodrug acid esters of [2-(4-benzyl-3-hydroxy-piperidin-1-yl)-ethansulfonyl]phenol HAO2, CYP2B6, CBR1 HDAC6 1255/4885MC4R 1996/4885HRH3 91/4885
US-20180334448-A1 Isocorydine derivatives, preparation method and use thereof CCND2, CCND3, IDH3A HDAC6 3766/4885MC4R 4580/4885HRH3 6/4885
US-10463743-B2 Amphiphilic drug-drug conjugates for cancer therapy, compositions and methods of preparation and uses thereof ABCB4, ABCB1, LCAT HDAC6 752/4885MC4R 4424/4885HRH3 2443/4885
US-20190029997-A1 SMALL MOLECULAR LUNG-TARGETING DRUG SLC7A5, SCNN1B, SLC43A1 HDAC6 91/4885MC4R 3000/4885HRH3 2649/4885

“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.