SCHEMBL5372580

SCHEMBL5372580

CC(=O)OC/C=C(\C)CO

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.59
ALOX15 P16050 2/20 0.59
PTPN1 P18031 1/20 0.47
BTN3A1 O00481 9/20 0.46
LMNA P02545 1/20 0.40
HSD17B10 Q99714 1/20 0.40
GALR3 O60755 1/20 0.33

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
SCHEMBL9013663 1.00 ALDH1A1 (0.59) ALDH1A1ALOX15PTPN1BTN3A1LMNA
Alcohol SCHEMBL4909375 0.96 ALDH1A1 (0.55) ALDH1A1ALOX15PTPN1BTN3A1LMNA
Formic Acid SCHEMBL9013905 0.94 ALDH1A1 (0.53) ALDH1A1ALOX15PTPN1BTN3A1LMNA
SCHEMBL1073135 0.88 ALDH1A1 (0.73) ALDH1A1ALOX15PTPN1BTN3A1
SCHEMBL9270945 0.88 ALDH1A1 (0.73) ALDH1A1ALOX15PTPN1BTN3A1
SCHEMBL1073133 0.88 ALDH1A1 (0.73) ALDH1A1ALOX15PTPN1BTN3A1
SCHEMBL3083781 0.88 ALDH1A1 (0.73) ALDH1A1ALOX15PTPN1BTN3A1
SCHEMBL9270948 0.88 ALDH1A1 (0.73) ALDH1A1ALOX15PTPN1BTN3A1
SCHEMBL4909382 0.84 BTN3A1 (0.44) ALDH1A1ALOX15PTPN1BTN3A1
SCHEMBL23036813 0.82 ALDH1A1 (0.66) ALDH1A1ALOX15PTPN1LMNAHSD17B10

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4021411-A Production of high molecular weight α,β-unsaturated aldehydes BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1977-05-03 US claimed
US-12357668-B2 Anticancer activity of Buddleja saligna compositions UNIVERSITY OF PRETORIA (ZA) 2025-07-15 US disclosed
US-20220088109-A1 Anticancer Activity of Buddleja Saligna Compositions UNIVERSITY OF PRETORIA (ZA) 2022-03-24 US disclosed
EP-3914276-A1 ANTICANCER ACTIVITY OF BUDDLEJA SALIGNA COMPOSITIONS University Of Pretoria (ZA) 2021-12-01 EP disclosed
WO-2020152577-A1 ANTICANCER ACTIVITY OF BUDDLEJA SALIGNA COMPOSITIONS UNIVERSITY OF PRETORIA (ZA) 2020-07-30 WO disclosed
US-20080200733-A1 Processes For The Preparation Of Purified Solanesol, Solanesyl Bromide & Solanesyl Acetone NICHOLAS PIRAMAL INDIA LIMITED (IN) 2008-08-21 US disclosed
US-7276622-B2 Method for producing oxygen-containing compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-02 US disclosed
WO-2007004090-A2 IMPROVED PROCESSES FOR THE PREPARATION OF PURIFIED SOLANESOL, SOLANESYL BROMIDE AND SOLANESYL ACETONE NICHOLAS PIRAMAL INDIA LIMITED (IN) 2007-01-11 WO disclosed
US-20060173221-A1 Method for producing oxygen-containing compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-08-03 US disclosed
EP-1609777-A1 METHOD FOR PRODUCING OXYGEN-CONTAINING COMPOUND Sumitomo Chemical Company, Limited (JP) 2005-12-28 EP disclosed
US-5527952-A Process for producing aldehyde derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-06-18 US disclosed
US-5424478-A Process for producing vitamin A derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-06-13 US disclosed
EP-0075238-B1 PROCESS FOR THE PREPARATION OF 3-ALKYL-3-ACYLOXY-4-HYDROXYBUTENES BASF Aktiengesellschaft (DE) 1984-11-28 EP disclosed
US-4466922-A COPPER CARBOXYLATE BASF AKTIENGESELLSCHAFT (DE) 1984-08-21 US disclosed
EP-0075238-A2 Process for the preparation of 3-alkyl-3-acyloxy-4-hydroxybutenes BASF Aktiengesellschaft (DE) 1983-03-30 EP disclosed
US-4021411-A Production of high molecular weight α,β-unsaturated aldehydes BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1977-05-03 US disclosed
US-3965193-A Production of high molecular weight α,β-unsaturated aldehydes BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-06-22 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 (2 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-20060173221-A1 Method for producing oxygen-containing compound GPX4, DUOX2, SCO2 ALDH1A1 863/4885ALOX15 76/4885PTPN1 4882/4885
US-20080200733-A1 Processes For The Preparation Of Purified Solanesol, Solanesyl Bromide & Solanesyl Acetone NDUFB10, SQOR, ACAA2 ALDH1A1 936/4885ALOX15 918/4885PTPN1 4270/4885

“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.