SCHEMBL1014784

SCHEMBL1014784

COC(=O)CC(=O)C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.46
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
EPHX1 P07099 2/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.38
NAAA Q02083 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL17525561 1.00 EPHX2 (0.46) EPHX2CES2CES1SMN1; SMN2HDAC8
SCHEMBL1013082 0.98 EPHX2 (0.43) EPHX2CES2CES1SMN1; SMN2HDAC8
SCHEMBL1017827 0.93 MGAM (0.42) EPHX2CES2CES1SMN1; SMN2HDAC8
SCHEMBL221809 0.89 GAA (0.46) EPHX2SMN1; SMN2MGAMGAASI
SCHEMBL20599527 0.84 SMN1; SMN2 (0.45) EPHX2SMN1; SMN2MGAMGAASI
SCHEMBL3656303 0.83 TSHR (0.52) EPHX2CES2CES1SMN1; SMN2HDAC8
SCHEMBL22559688 0.83 TSHR (0.52) EPHX2CES2CES1SMN1; SMN2HDAC8
SCHEMBL434421 0.82 MGAM (0.52) SMN1; SMN2MGAMGAASIMGAM2
SCHEMBL599277 0.81 CES2 (0.55) EPHX2CES2CES1SMN1; SMN2HDAC8
SCHEMBL29333109 0.81 CES2 (0.55) EPHX2CES2CES1SMN1; SMN2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6410757-B1 TAXANE COMPOUNDS BIO RESEARCH CORPORATION OF YOKOHAMA (JP) 2002-06-25 US claimed
CN-111491935-B Novel analogs as modulators of androgen and glucocorticoid receptors 昂科斯特拉公司 2023-08-22 CN disclosed
US-11639350-B2 Heteroaryldihydropyrimidine derivatives and methods of treating hepatitis B infections JANSSEN PHARMACEUTICA NV (BE) 2023-05-02 US disclosed
EP-3707143-B9 NEW ANALOGS AS ANDROGEN RECEPTOR AND GLUCOCORTICOID RECEPTOR MODULATORS ONCOSTELLAE S L (ES) 2023-04-12 EP disclosed
EP-3707143-B1 NEW ANALOGS AS ANDROGEN RECEPTOR AND GLUCOCORTICOID RECEPTOR MODULATORS ONCOSTELLAE S L (ES) 2022-12-28 EP disclosed
US-11453660-B2 Androgen receptor and glucocorticoid receptor modulators ONCOSTELLAE, S.L. 2022-09-27 US disclosed
US-20200325123-A1 NEW ANALOGS AS ANDROGEN RECEPTOR AND GLUCOCORTICOID RECEPTOR MODULATORS ONCOSTELLAE, S.L. (ES) 2020-10-15 US disclosed
EP-3707143-A1 NEW ANALOGS AS ANDROGEN RECEPTOR AND GLUCOCORTICOID RECEPTOR MODULATORS Oncostellae, S.L. (ES) 2020-09-16 EP disclosed
CN-111491935-A Novel analogs as androgen receptor and glucocorticoid receptor modulators 昂科斯特拉公司 2020-08-04 CN disclosed
US-20200172532-A1 HETEROARYLDIHYDROPYRIMIDINE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS JANSSEN PHARMACEUTICA NV (BE) 2020-06-04 US disclosed
EP-1029857-A1 Baccatin derivatives and a process for producing the same Bio Research Corporation of Yokohama (JP) 2000-08-23 EP disclosed
EP-0456073-B1 Multifunctional compounds having alpha-diazo-beta-ketoester units and sulfonic acid ester units and process for their preparation. HOECHST AG (DE) 1995-10-25 EP disclosed
EP-0378067-B1 Positively working radiation-sensitive mixture containing a multifunctional alpha-diazo-beta-keto ester, process for its preparation and a radiation-sensitive recording material containing this mixture HOECHST AG (DE) 1995-05-31 EP disclosed
EP-0378068-B1 NEW POLYFUNCTIONAL ALPHA-DIAZO-BETA-KETO ESTERS, PROCESS FOR THEIR PREPARATION AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-31 EP disclosed
US-5198322-A Positively operating radiation-sensitive mixture containing a polyfunctional α-diazo-β-keto ester and radiation-sensitive recording material containing this mixture HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-30 US disclosed
US-5191069-A Photosensitive compounds with heat resistance HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-02 US disclosed
EP-0456073-A2 Multifunctional compounds having alpha-diazo-beta-ketoester units and sulfonic acid ester units and process for their preparation. HOECHST AKTIENGESELLSCHAFT (DE) 1991-11-13 EP disclosed
US-4996301-A Polyfunctional α-diazo-β-keto esters and their use in light-sensitive compositions HOECHST AKTIENGESELLSCHAFT (DE) 1991-02-26 US disclosed
EP-0378067-A2 Positively working radiation-sensitive mixture containing a multifunctional alpha-diazo-beta-keto ester, process for its preparation and a radiation-sensitive recording material containing this mixture HOECHST AKTIENGESELLSCHAFT (DE) 1990-07-18 EP disclosed
EP-0378068-A1 New polyfunctional alpha-diazo-beta-keto esters, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1990-07-18 EP 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-20200172532-A1 HETEROARYLDIHYDROPYRIMIDINE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, HCCS, PYGL EPHX2 1439/4885CES2 1269/4885CES1 134/4885
US-20200325123-A1 NEW ANALOGS AS ANDROGEN RECEPTOR AND GLUCOCORTICOID RECEPTOR MODULATORS NR5A1, AR, NR3C1 EPHX2 4813/4885CES2 4076/4885CES1 1447/4885
US-11639350-B2 Heteroaryldihydropyrimidine derivatives and methods of treating hepatitis B infections HCCS, HAVCR2, NR1H4 EPHX2 708/4885CES2 2000/4885CES1 206/4885
US-11453660-B2 Androgen receptor and glucocorticoid receptor modulators AR, NR5A1, NR3C1 EPHX2 4814/4885CES2 4177/4885CES1 1882/4885

“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.