SCHEMBL619634

SCHEMBL619634

O=C(O)c1ccc2c(c1)OCCO2

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.78
ALDH1A1 P00352 2/20 0.78
TSHR P16473 3/20 0.69
STAT3 P40763 1/20 0.64
PKM P14618 2/20 0.64
KDM4E B2RXH2 4/20 0.62
SRD5A2 P31213 1/20 0.62
ATM Q13315 1/20 0.62
CTNNB1 P35222 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62
MAPT P10636 1/20 0.62
NPC1 O15118 3/20 0.60
RAB9A P51151 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
NFKB1 P19838 1/20 0.60
MAOB P27338 1/20 0.60
NFKB2 Q00653 1/20 0.60
RELA Q04206 1/20 0.60
HPGD P15428 2/20 0.59
RECQL P46063 1/20 0.57

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
Formaldehyde SCHEMBL27289523 0.96 MAPK1 (0.72) MAPK1ALDH1A1TSHRSTAT3PKM
SCHEMBL29363947 0.94 KDM4E (0.72) MAPK1ALDH1A1TSHRSTAT3PKM
SCHEMBL22292225 0.94 KDM4E (0.72) MAPK1ALDH1A1TSHRSTAT3PKM
SCHEMBL16784086 0.94 KDM4E (0.72) MAPK1ALDH1A1TSHRSTAT3PKM
SCHEMBL16784085 0.94 KDM4E (0.72) MAPK1ALDH1A1TSHRSTAT3PKM
SCHEMBL2807412 0.94 KDM4E (0.72) MAPK1ALDH1A1TSHRSTAT3PKM
SCHEMBL12445338 0.94 KDM4E (0.72) MAPK1ALDH1A1TSHRSTAT3PKM
SCHEMBL2806009 0.94 KDM4E (0.72) MAPK1ALDH1A1TSHRSTAT3PKM
SCHEMBL10031399 0.94 KDM4E (0.72) MAPK1ALDH1A1TSHRSTAT3PKM
SCHEMBL3064183 0.92 ALDH1A1 (0.72) MAPK1ALDH1A1TSHRSTAT3PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119431432-A Andrographolide diester derivative, preparation method and application 西北农林科技大学 2025-02-14 CN claimed
CN-118340765-A Application of benzamide compound in preparation of wound healing promoting medicine 广州市朝利良生物科技有限公司 2024-07-16 CN claimed
CN-118271276-A Naphthalenone derivative for promoting wound healing as well as preparation method and application thereof 广州市朝利良生物科技有限公司 2024-07-02 CN claimed
CN-115368346-B 1, 4-benzodioxane-benzimidazole salt compound and synthesis method and application thereof 曲靖师范学院 2024-04-09 CN claimed
CN-114057625-B C2-acyloxy-3-indolinone derivative and preparation method and application thereof 五邑大学 2023-11-24 CN claimed
US-20220388975-A1 SULFONAMIDE BENZAMIDE DERIVATIVE AND PREPARATION METHOD AND APPLICATION THEREOF WEIFANG MEDICAL UNIVERSITY (CN) 2022-12-08 US claimed
CN-115368346-A 1, 4-benzodioxan-benzimidazole salt compound and synthesis method and application thereof 曲靖师范学院 2022-11-22 CN claimed
CN-112939778-B Coumarin compound ester derivatives, preparation method and application thereof 西北农林科技大学 2022-08-02 CN claimed
US-20210395238-A1 NADPH OXIDASE 4 INHIBITORS ACTELTION PHARMACEUTICALS LTD (CH) 2021-12-23 US claimed
CN-112939778-A Coumarin compound ester derivatives, preparation method and application thereof 西北农林科技大学 2021-06-11 CN claimed
WO-2004089416-A2 COMBINATION OF AN 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITOR AND AN ANTIHYPERTENSIVE AGENT NOVO NORDISK A/S (DK) 2004-10-21 WO claimed
WO-2004089470-A2 NEW AMIDE DERIVATIVES AND PHARMACEUTICAL USE THEREOF NOVO NORDISK A/S (DK) 2004-10-21 WO claimed
US-20040138219-A1 Quinolines and nitrogenated derivative therof substituted in 4-position by a piperidine-containing moiety and their use as antibacterial agents SMITHKLINE BEECHAM P.L.C. (GB) 2004-07-15 US claimed
WO-2004052919-A2 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-06-24 WO claimed
EP-1359908-A1 QUINOLINES AND NITROGENATED DERIVATIVES THEREOF SUBSTITUTED IN 4-POSITION BY A PIPERIDINE-CONTAINING MOIETY AND THEIR USE AS ANTIBACTERIAL AGENTS SMITHKLINE BEECHAM PLC (GB) 2003-11-12 EP claimed
CN-1116271-C Method of producing 2 -substituted -3, 4 -fused heterocycle benzoic acid DOW AGROSCIENCES CORP (US) 2003-07-30 CN claimed
WO-2002056882-A1 QUINOLINES AND NITROGENATED DERIVAIVE THEREOF SUBSTITUTED IN 4-POSITION BY A PIPERIDINE-CONTAINING MOIETY AND THEIR USE AS ANTIBACTERIAL AGENTS SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-25 WO claimed
CN-1182075-A Method of producing 2 -substituted -3, 4 -fused heterocycle benzoic acid ROHM & HAAS (US) 1998-05-20 CN claimed
EP-0729953-A2 A process for producing a 2-substituted-3,4-fused heterocyclic benzoic acid ROHM AND HAAS COMPANY (US) 1996-09-04 EP claimed
EP-0602794-A2 Insecticidal N'-substituted-N, N'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1994-06-22 EP 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 (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-20220388975-A1 SULFONAMIDE BENZAMIDE DERIVATIVE AND PREPARATION METHOD AND APPLICATION THEREOF PCNA, DNA2, HBS1L MAPK1 3019/4885ALDH1A1 3483/4885TSHR 2578/4885
US-20040138219-A1 Quinolines and nitrogenated derivative therof substituted in 4-position by a piperidine-containing moiety and their use as antibacterial agents NCF1, TEAD1, TYMS MAPK1 3767/4885ALDH1A1 1742/4885TSHR 3653/4885
US-20210395238-A1 NADPH OXIDASE 4 INHIBITORS NOX4, NOX1, CYBB MAPK1 373/4885ALDH1A1 176/4885TSHR 4022/4885

“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.