SCHEMBL2014272

SCHEMBL2014272

O=C1CCC2CC=CC=C2O1

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31

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
SCHEMBL785508 0.81 CTRB1 (0.34)
SCHEMBL7358051 0.81
SCHEMBL302005 0.68
Cyclohexanone SCHEMBL28357381 0.68 TRIM24 (0.34)
SCHEMBL26129174 0.68
Hydrochloric Acid SCHEMBL8122291 0.67
SCHEMBL27526976 0.67 MAPT (0.30)
SCHEMBL27675698 0.67
SCHEMBL9344374 0.66
SCHEMBL2310348 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110917232-A Method for applying medical natural product targeted medicine of dandelion extracted by hydrothermal method to mainly treat dermatitis allergy 苏州科技大学 2020-03-27 CN claimed
CN-214937133-U Delta-valerolactone purification device 迈奇化学股份有限公司 2021-11-30 CN disclosed
CN-109651318-B Preparation method of valerolactone 万华化学集团股份有限公司 2020-11-24 CN disclosed
CN-107987044-B Method for preparing valerolactone 万华化学集团股份有限公司 2020-08-28 CN disclosed
CN-106674173-B Dehydrogenation catalyst and method for preparing valerolactone 万华化学集团股份有限公司 2020-07-28 CN disclosed
CN-110917232-A Method for applying medical natural product targeted medicine of dandelion extracted by hydrothermal method to mainly treat dermatitis allergy 苏州科技大学 2020-03-27 CN disclosed
CN-110917232-A Method for applying medical natural product targeted medicine of dandelion extracted by hydrothermal method to mainly treat dermatitis allergy 苏州科技大学 2020-03-27 CN disclosed
CN-107954951-B Method for manufacturing delta-valerolactone 万华化学集团股份有限公司 2020-03-03 CN disclosed
US-10336737-B2 Metal catalyzed dearomative 1,2-carboamination THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2019-07-02 US disclosed
US-20180362513-A1 METAL CATALYZED DEAROMATIVE 1,2-CARBOAMINATION THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2018-12-20 US disclosed
EP-3218425-A1 SILICONE COMPOUNDS The Procter and Gamble Company (US) 2017-09-20 EP disclosed
WO-2016077513-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2016-05-19 WO disclosed
WO-2011075353-A1 COMPOSITION COMPRISING MICROCAPSULES THE PROCTER & GAMBLE COMPANY (US) 2011-06-23 WO disclosed
WO-2003074044-A1 SUBSTITUTED BENZOPYRANS AS SELECTIVE ESTROGEN RECEPTOR-BETA AGONISTS ELI LILLY AND COMPANY (US) 2003-09-12 WO disclosed
US-5750139-A CONTAINED IN INNER SPACE BETWEEN IMPERMEABLE TOP LAYER AND MICROPOROUS MEMBRANE WELDED TOGATHER DROSSAPHARM AG (CH) 1998-05-12 US disclosed
EP-0668074-A1 Pharmaceutical composition Drossapharm AG (CH) 1995-08-23 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-10336737-B2 Metal catalyzed dearomative 1,2-carboamination DNTT, DIMT1, NMT1 TSHR 2648/4885
US-20180362513-A1 METAL CATALYZED DEAROMATIVE 1,2-CARBOAMINATION DNTT, DIMT1, NMT1 TSHR 2648/4885

“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.