SCHEMBL4412203

SCHEMBL4412203

O=C(O)C(O)C1CCCC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.42
ALDH1A1 P00352 2/20 0.39
TP53 P04637 1/20 0.37
DPP4 P27487 1/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GMNN O75496 1/20 0.36
LMNA P02545 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35

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
SCHEMBL16837771 1.00 EPHX1 (0.42) EPHX1ALDH1A1TP53DPP4SMN1; SMN2
SCHEMBL8031374 1.00 EPHX1 (0.42) EPHX1ALDH1A1TP53DPP4SMN1; SMN2
SCHEMBL503695 0.97 EPHX1 (0.46) EPHX1ALDH1A1TP53DPP4SMN1; SMN2
SCHEMBL8031276 0.97 EPHX1 (0.46) EPHX1ALDH1A1TP53DPP4SMN1; SMN2
SCHEMBL360610 0.97 EPHX1 (0.46) EPHX1ALDH1A1TP53DPP4SMN1; SMN2
SCHEMBL5686769 0.97 EPHX1 (0.46) EPHX1ALDH1A1TP53DPP4SMN1; SMN2
SCHEMBL67018 0.97 EPHX1 (0.46) EPHX1ALDH1A1TP53DPP4SMN1; SMN2
Hydrochloric Acid SCHEMBL5515976 0.95 EPHX1 (0.44) EPHX1ALDH1A1TP53DPP4SMN1; SMN2
Benzene SCHEMBL18322786 0.95 EPHX1 (0.39) EPHX1ALDH1A1TP53MAPTKDM4E
SCHEMBL16837724 0.94

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030130188-A1 Heterocyclic compounds, pharmaceutical compositions comprising same, and methods for inhibiting beta-amyloid peptide release and/or its synthesis by use of such compounds THORSETT EUGENE D (US) 2003-07-10 US claimed
US-12637406-B2 Diester structure monomer, preparation method therefor, and application thereof Ningbo Nata Opto-electronic Material Co., Ltd. (CN) 2026-05-26 US disclosed
US-20250388604-A1 Compounds and Their Use as PDE4 Activators MIRONID LIMITED (GB) 2025-12-25 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-20220234985-A1 DIESTER STRUCTURE MONOMER, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF Ningbo Nata Opto-electronic Material Co., Ltd. (CN) 2022-07-28 US disclosed
EP-3027666-B1 POLYMER CONTAINING SILANE GROUPS SIKA TECH AG (CH) 2021-11-17 EP disclosed
EP-3027628-B1 HYDROXYMETHYLCARBOXAMIDO-SUBSTITUTED SILANOLE FOR HARDENABLE SILANE-TERMINATING POLYMERS SIKA TECH AG (CH) 2020-07-15 EP disclosed
CN-105408337-B Hydroxymethyl carboxamido substituted silanols for curable silane terminated polymers SIKA技术股份公司 2020-03-24 CN disclosed
US-9850260-B2 Hydroxymethyl-carboxamido-substituted silane and its use for curable, silane-terminated polymers SIKA TECHNOLOGY AG (CH) 2017-12-26 US disclosed
US-9790315-B2 Polymer containing silane groups SIKA TECHNOLOGY AG (CH) 2017-10-17 US disclosed
US-6121241-A TREATING CARDIOVASCULAR DISORDERS GYOGYSZERKUTATO INTEZET KFT. (HU) 2000-09-19 US disclosed
EP-0863871-B1 ANTICOAGULANT PEPTIDE ALDEHYDE DERIVATIVES GYOGYSZERKUTATO INTEZET (HU) 2000-03-08 EP disclosed
EP-0968198-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE FOR INHIBITING $g(b)-AMYLOID PEPTIDE Elan Pharmaceuticals, Inc. (US) 2000-01-05 EP disclosed
WO-1999067220-A1 COMPOUNDS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS ELAN PHARMACEUTICALS, INC. (US) 1999-12-29 WO disclosed
EP-0951466-A2 CYCLOALKYL, LACTAM, LACTONE AND RELATED COMPOUNDS, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS BY USE OF SUCH COMPOUNDS Elan Pharmaceuticals, Inc. (US) 1999-10-27 EP disclosed
EP-0863871-A1 ANTICOAGULANT PEPTIDE ALDEHYDE DERIVATIVES GYOGYSZERKUTATO INTEZET KFT. (HU) 1998-09-16 EP disclosed
WO-1998038177-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE FOR INHIBITING β-AMYLOID PEPTIDE ELAN PHARMACEUTICALS, INC. (US) 1998-09-03 WO disclosed
WO-1998028268-A2 CYCLOALKYL, LACTAM, LACTONE AND RELATED COMPOUNDS AS β-AMYLOID PEPTIDE RELEASE INHIBITORS ELAN PHARMACEUTICALS, INC. (US) 1998-07-02 WO disclosed
WO-1997046523-A1 ANTICOAGULANT PEPTIDE ALDEHYDE DERIVATIVES Gyógyszerkutató Intézet Kft. (HU) 1997-12-11 WO disclosed
US-4735932-A ORGANOLEPTIC INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1988-04-05 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 (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-12637406-B2 Diester structure monomer, preparation method therefor, and application thereof CDH1, SMCHD1, CAD EPHX1 2108/4885ALDH1A1 1367/4885TP53 3012/4885
US-20030130188-A1 Heterocyclic compounds, pharmaceutical compositions comprising same, and methods for inhibiting beta-amyloid peptide release and/or its synthesis by use of such compounds APP, BACE1, IAPP EPHX1 1062/4885ALDH1A1 3575/4885TP53 787/4885
US-20220234985-A1 DIESTER STRUCTURE MONOMER, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF SUV39H1, DAGLA, FAM162A EPHX1 1580/4885ALDH1A1 1496/4885TP53 2117/4885
US-20250388604-A1 Compounds and Their Use as PDE4 Activators PDE4A, PDE7A, PDE4B EPHX1 1796/4885ALDH1A1 989/4885TP53 4753/4885

“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.