SCHEMBL1834280

SCHEMBL1834280

COC(=O)CCCCCCC1=CCCC1=O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.43
TSHR P16473 2/20 0.41
KAT2B Q92831 3/20 0.41
LMNA P02545 2/20 0.39
ALDH1A1 P00352 2/20 0.39
PTGER2 P43116 1/20 0.38
PTPRC P08575 2/20 0.38
PTPN13 Q12923 1/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
P2RY12 Q9H244 1/20 0.38
KMT2A Q03164 1/20 0.37
GSTP1 P09211 1/20 0.37
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL9857324 1.00 HPGD (0.43) HPGDTSHRKAT2BLMNAALDH1A1
SCHEMBL9623592 1.00 HPGD (0.43) HPGDTSHRKAT2BLMNAALDH1A1
SCHEMBL11701038 1.00 HPGD (0.43) HPGDTSHRKAT2BLMNAALDH1A1
SCHEMBL11762132 0.98 TSHR (0.42) HPGDTSHRKAT2BLMNAALDH1A1
SCHEMBL11764316 0.94 TSHR (0.44) HPGDTSHRKAT2BLMNAALDH1A1
SCHEMBL9623083 0.91 GSTP1 (0.45) HPGDTSHRKAT2BLMNAALDH1A1
SCHEMBL9623169 0.91 GSTP1 (0.45) HPGDTSHRKAT2BLMNAALDH1A1
SCHEMBL11698888 0.87 GSTP1 (0.40) HPGDTSHRKAT2BLMNAALDH1A1
SCHEMBL10684040 0.85 CYP4F2 (0.46) TSHRALDH1A1KMT2AGSTP1GAA
SCHEMBL11106157 0.85 CYP4F2 (0.46) TSHRALDH1A1KMT2AGSTP1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4142056-A MULTISTAGE PROCESS FOR PREPARING 2-(6'-CARBOMETHOXYHEXYL)-2-CYCLOPENTEN-1-ONE WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1979-02-27 US claimed
CN-108929225-B Methyl pelargonate separating and purifying method 浙江工业大学 2021-06-08 CN disclosed
US-10759734-B2 Process for the preparation and purification of misoprostol CHINOIN PHARMACEUTICAL AND CHEMICAL WORKS PRIVATE COMPANY LTD. (HU) 2020-09-01 US disclosed
US-20200165186-A1 PROCESS FOR THE PREPARATION AND PURIFICATION OF MISOPROSTOL CHINOIN PHARMACEUTICAL AND CHEMICAL WORKS PRIVATE CO. LTD. (HU) 2020-05-28 US disclosed
EP-2188380-B1 Method for the coproduction of methyl 7-oxoheptanoate and undecylenic acid from ricinoleic acid ARKEMA FRANCE (FR) 2011-05-11 EP disclosed
US-20100203600-A1 METHOD FOR THE COPRODUCTION OF METHYL 7-OXOHEPTANOATE AND UNDECYLENIC ACID FROM RICINOLEIC ACID ARKEMA FRANCE (FR) 2010-08-12 US disclosed
EP-2188380-A2 METHOD FOR THE COPRODUCTION OF METHYL 7-OXOHEPTANOATE AND UNDECYLENIC ACID FROM RICINOLEIC ACID ARKEMA FRANCE (FR) 2010-05-26 EP disclosed
WO-2009047446-A2 METHOD FOR THE COPRODUCTION OF METHYL 7-OXOHEPTANOATE AND UNDECYLENIC ACID FROM RICINOLEIC ACID ARKEMA FRANCE (FR) 2009-04-16 WO disclosed
EP-1716113-B1 EP2- RECEPTOR AGONISTS ASTERAND UK LTD (GB) 2009-02-25 EP disclosed
EP-1716113-B1 EP2- RECEPTOR AGONISTS ASTERAND UK LTD (GB) 2009-02-25 EP disclosed
US-4039563-A Process for preparing cyclopent-2-en-1-one derivatives TEIJIN LIMITED (JA) 1977-08-02 US disclosed
US-4031129-A LITHIUM CYCLOPENTADIENE, ETHYL-7-BROMOHEPTANOATE WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1977-06-21 US disclosed
US-4029698-A Cycloalkylidenol analogues of prostaglandins E and F MILES LABORATORIES, INC. (US) 1977-06-14 US disclosed
US-4018811-A MICROBIOCIDES, ANTIULCER, HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1977-04-19 US disclosed
US-4007210-A PROSTANOIC ACID DERIVATIVES AMERICAN CYANAMID COMPANY (US) 1977-02-08 US disclosed
US-4004027-A Prostaglandin antagonists AYERST MCKENNA AND HARRISON LTD. (CA) 1977-01-18 US disclosed
US-3993674-A ANTIULCER, BRONCHODILATOR, HYPOTENSIVE AMERICAN CYANAMID COMPANY (US) 1976-11-23 US disclosed
US-3970683-A 11,15-Dihydroxy-9-oxoprost-13-ynoic acid G. D. SEARLE & CO. (US) 1976-07-20 US disclosed
US-3966773-A BRONCHODILATOR, HYPOTENSIVE, ANTIULCER AMERICAN CYANAMID COMPANY (US) 1976-06-29 US disclosed
US-3932479-A BRONCHODILATOR, HYPOTENSIVE, ANTIULCER AMERICAN CYANAMID COMPANY (US) 1976-01-13 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-10759734-B2 Process for the preparation and purification of misoprostol F12, VKORC1L1, SART3 HPGD 302/4885TSHR 773/4885KAT2B 1935/4885
US-20200165186-A1 PROCESS FOR THE PREPARATION AND PURIFICATION OF MISOPROSTOL SART3, TBL3, TMSB4X HPGD 1488/4885TSHR 70/4885KAT2B 1932/4885

“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.