SCHEMBL6973425

SCHEMBL6973425

C/C=C/CCC(=O)OCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.52
PGR P06401 1/20 0.52
ADORA3 P0DMS8 1/20 0.52
PTGS2 P35354 1/20 0.52
PDE4D Q08499 1/20 0.52
ALDH1A1 P00352 4/20 0.49
HSD17B10 Q99714 2/20 0.49
TSHR P16473 2/20 0.49
ALOX15 P16050 2/20 0.49
CYP3A4 P08684 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CYP1A2 P05177 1/20 0.48
GAA P10253 2/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
TRPA1 O75762 1/20 0.44
CYP4F2 P78329 2/20 0.40
CYP4A11 Q02928 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL11793409 1.00 NR1I2 (0.52) NR1I2PGRADORA3PTGS2PDE4D
SCHEMBL31275312 0.96 NR1I2 (0.53) NR1I2PGRADORA3PTGS2PDE4D
SCHEMBL9183887 0.91 NR1I2 (0.60) NR1I2PGRADORA3PTGS2PDE4D
SCHEMBL9183882 0.91 NR1I2 (0.60) NR1I2PGRADORA3PTGS2PDE4D
SCHEMBL13394318 0.90 NR1I2 (0.62) NR1I2PGRADORA3PTGS2PDE4D
SCHEMBL10300850 0.88 NR1I2 (0.46) NR1I2PGRADORA3PTGS2PDE4D
SCHEMBL2683632 0.88 NR1I2 (0.46) NR1I2PGRADORA3PTGS2PDE4D
SCHEMBL2683633 0.88 NR1I2 (0.46) NR1I2PGRADORA3PTGS2PDE4D
SCHEMBL10902814 0.87 NR1I2 (0.68) NR1I2PGRADORA3PTGS2PDE4D
SCHEMBL10904416 0.87 NR1I2 (0.68) NR1I2PGRADORA3PTGS2PDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3214168-B1 SACCHAROMYCES CEREVISIAE CAPABLE OF BEING CO-FERMENTED BY MULTIPLE CARBON SOURCES AND APPLICATION THEREOF UNIV JIANGNAN (CN) 2019-08-07 EP claimed
EP-3214168-A1 SACCHAROMYCES CEREVISIAE CAPABLE OF BEING CO-FERMENTED BY MULTIPLE CARBON SOURCES AND APPLICATION THEREOF Jiangnan University (CN) 2017-09-06 EP claimed
US-12593851-B2 Leavening agents PURATOS NV (BE) 2026-04-07 US disclosed
US-20250188201-A1 CATALYST FOR PHOTOCATALYTIC POLYMERIZATION REACTION, AND APPLICATION THEREOF BEIJING INSTITUTE OF FASHION TECHNOLOGY (CN) 2025-06-12 US disclosed
CN-112142670-A Preparation method of caprolactam 浙江恒澜科技有限公司 2020-12-29 CN disclosed
CN-112079759-A Caprolactam production device and production method 浙江恒澜科技有限公司 2020-12-15 CN disclosed
EP-3214168-B1 SACCHAROMYCES CEREVISIAE CAPABLE OF BEING CO-FERMENTED BY MULTIPLE CARBON SOURCES AND APPLICATION THEREOF UNIV JIANGNAN (CN) 2019-08-07 EP disclosed
US-20190053502-A1 LEAVENING AGENTS PURATOS NV (BE) 2019-02-21 US disclosed
US-20180098952-A1 INACTIVATORS OF TOXOPLASMA GONDII ORNITHINE AMINOTRANSFERASE FOR TREATING TOXOPLASMOSIS AND MALARIA NORTHWESTERN UNIVERSITY (US) 2018-04-12 US disclosed
EP-3214168-A1 SACCHAROMYCES CEREVISIAE CAPABLE OF BEING CO-FERMENTED BY MULTIPLE CARBON SOURCES AND APPLICATION THEREOF Jiangnan University (CN) 2017-09-06 EP disclosed
WO-2017060230-A1 LEAVENING AGENTS PURATOS NV (BE) 2017-04-13 WO disclosed
EP-1295875-A1 HETEROCYCLIC COMPOUNDS Nippon Shinyaku Co., Ltd. (JP) 2003-03-26 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 (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-20180098952-A1 INACTIVATORS OF TOXOPLASMA GONDII ORNITHINE AMINOTRANSFERASE FOR TREATING TOXOPLASMOSIS AND MALARIA OAT, OTC, ABAT NR1I2 1129/4885PGR 4162/4885ADORA3 1128/4885
US-12593851-B2 Leavening agents LCT, CHIA, TREH NR1I2 4875/4885PGR 4105/4885ADORA3 4631/4885

“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.