SCHEMBL4815549

SCHEMBL4815549

O=Cc1ccc(OB(O)O)s1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
DPP4 P27487 1/20 0.34
CYP2E1 P05181 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2A6 P11509 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2B6 P20813 1/20 0.33
CYP2C19 P33261 1/20 0.33
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 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
SCHEMBL4824358 0.78
SCHEMBL125451 0.72
SCHEMBL27492784 0.72 ALDH1A1 (0.37) ALDH1A1DPP4CYP2E1CYP3A4CYP2A6
SCHEMBL12339807 0.72 ALDH1A1 (0.34) ALDH1A1DPP4CYP2E1CYP3A4CYP2A6
SCHEMBL38655959 0.71 MEN1 (0.35) ALDH1A1DPP4CYP2E1CYP3A4CYP2A6
SCHEMBL4325866 0.71 ALDH1A1 (0.37) ALDH1A1DPP4CYP2E1CYP3A4CYP2A6
2,5-Thiophenenedicarboxaldehyde SCHEMBL178830 0.69
SCHEMBL31427498 0.68 CES2 (0.37)
SCHEMBL178042 0.68 TSHR (0.46) ALDH1A1DPP4CYP2E1CYP3A4CYP2A6
SCHEMBL28979724 0.68 DAO (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119504701-A Novel fluorescent probe based on triphenylamine and preparation method and application thereof 广东医科大学 2025-02-25 CN claimed
CN-114195774-B Photosensitizer with hypochlorous acid activated fluorescence and mitochondrial targeting functions and preparation method and application thereof 徐州医科大学 2023-09-26 CN claimed
CN-114609102-B Method for in-situ monitoring polymer film forming process by using fluorescent probe 四川大学 2023-07-28 CN claimed
CN-114609102-A Method for in-situ monitoring of polymer film forming process by using fluorescent probe 四川大学 2022-06-10 CN claimed
CN-114195774-A Photosensitizer with hypochlorous acid activated fluorescence and mitochondrion targeting functions and preparation method and application thereof 徐州医科大学 2022-03-18 CN claimed
CN-122031387-A Diagnosis and treatment integrated viscosity response self-assembled nano micelle and preparation method and application thereof 山西医科大学 2026-05-15 CN disclosed
CN-122042081-A Ratio type fluorescent nano thermometer based on temperature response type amphiphilic polymer and preparation and application thereof 西安交通大学 2026-05-15 CN disclosed
CN-119504701-B Novel fluorescent probe based on triphenylamine and preparation method and application thereof 广东医科大学 2025-10-03 CN disclosed
CN-119504701-A Novel fluorescent probe based on triphenylamine and preparation method and application thereof 广东医科大学 2025-02-25 CN disclosed
CN-119504701-A Novel fluorescent probe based on triphenylamine and preparation method and application thereof 广东医科大学 2025-02-25 CN disclosed
CN-114195774-B Photosensitizer with hypochlorous acid activated fluorescence and mitochondrial targeting functions and preparation method and application thereof 徐州医科大学 2023-09-26 CN disclosed
CN-111892592-B JAK kinase inhibitors and uses thereof 江苏柯菲平医药股份有限公司 2023-09-19 CN disclosed
EP-3124482-B1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO LTD (CN) 2019-09-11 EP disclosed
US-9938292-B2 Quinoline derivatives as SMO inhibitors GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-04-10 US disclosed
US-20170174703-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-06-22 US disclosed
EP-3124482-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-02-01 EP disclosed
US-7425563-B2 Excellent poly (ADP-ribose) synthetase inhibitors; various ischemic diseases, inflammatory diseases, neurodegenerative diseases, diabetes, septic shock, cephalic injury; 1,2-Dihydro-4-[4-(dimethylaminomethyl)phenyl]-5-hydroxy-1-oxoisoquinoline KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-09-16 US disclosed
US-20060173039-A1 4-(Substituted aryl)-5-hydroxyisoquinolinone derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2006-08-03 US disclosed
EP-1544194-A1 4-(SUBSTITUTED ARYL)-5-HYDROXYISOQUINOLINONE DERIVATIVE KYORIN PHARMACEUTICAL CO., LTD. (JP) 2005-06-22 EP disclosed
US-20040242572-A1 New carboxamide compounds having melanin concentrating hormone antagonistic activity, pharmaceutical preparations comprising these compounds and process for their manufacture BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2004-12-02 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 (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-20060173039-A1 4-(Substituted aryl)-5-hydroxyisoquinolinone derivative PARP1, PARP11, PARP4 ALDH1A1 58/4885DPP4 110/4885CYP2E1 1474/4885
US-20040242572-A1 New carboxamide compounds having melanin concentrating hormone antagonistic activity, pharmaceutical preparations comprising these compounds and process for their manufacture MCHR2, MCHR1, NPY1R ALDH1A1 3363/4885DPP4 550/4885CYP2E1 2129/4885
US-20170174703-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS SMO, GLI1, SHH ALDH1A1 892/4885DPP4 3025/4885CYP2E1 4374/4885

“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.