SCHEMBL2597432

SCHEMBL2597432

Cc1cc(C)c2c(c1C)OC(C)(C(=O)O)CC2

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.62
PTGS2 P35354 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
TSHR P16473 1/20 0.62
PSEN1 P49768 9/20 0.52
ALOX5 P09917 1/20 0.35
BCHE P06276 6/20 0.35
ACHE P22303 6/20 0.35
TTPA P49638 1/20 0.34

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
SCHEMBL23961349 0.88 PTGS1 (0.48) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL7453293 0.87 PTGS1 (0.47) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL20819462 0.84 PTGS1 (0.45) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL10071787 0.84 PTGS1 (0.45) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL15150900 0.82 PSEN1 (0.47) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL11705987 0.82 PTGS1 (0.41) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL13933085 0.81 PTGS1 (0.79) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL4278692 0.79 PTGS1 (0.63) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL5460830 0.79 PTGS1 (0.36) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL29242853 0.79 PSEN1 (0.53) PTGS1PTGS2CYP1A2CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962246-B2 Method for providing DNA fragments derived from an archived sample EPIGENOMICS AG (DE) 2015-02-24 US claimed
EP-1869215-B1 IMPROVED BISULFITE CONVERSION OF DNA EPIGENOMICS AG (DE) 2014-05-07 EP claimed
US-20140087449-A1 Method for Providing DNA Fragments Derived from an Archived Sample EPIGENOMICS AG (DE) 2014-03-27 US claimed
US-20040053993-A1 Compositions of tocol-soluble therapeutics SONUS PHARMACEUTICALS, INC. 2004-03-18 US claimed
US-6479540-B1 Compositions of tocol-soluble therapeutics SONUS PHARMACEUTICALS, INC. 2002-11-12 US claimed
EP-1216026-A1 COMPOSITIONS OF TOCOL-SOLUBLE THERAPEUTICS SONUS PHARMACEUTICALS, INC. (US) 2002-06-26 EP claimed
WO-2001022937-A1 COMPOSITIONS OF TOCOL-SOLUBLE THERAPEUTICS SONUS PHARMACEUTICALS, INC. (US) 2001-04-05 WO claimed
WO-2023066775-A1 SUPRAPARTICLE AND ADDITIVE FOR OPTICALLY INDICATING HYDROGEN GAS, METHOD FOR PRODUCING THE SUPRAPARTICLE(S) OR THE ADDITIVE, AND USE OF THE SUPRAPARTICLE(S) OR THE ADDITIVE Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2023-04-27 WO disclosed
WO-2021141926-A1 METHOD, AND SYSTEM FOR MULTI-LAYER COSMETIC PADS AND USE THEREOF ELC MANAGEMENT LLC (US) 2021-07-15 WO disclosed
CN-107638316-A Purposes and skin care item of the Cordyceps sinensis fungus products of cellular metabolism in skin care item are prepared 徐跃 2018-01-30 CN disclosed
EP-2838899-B1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PREPARATION AND USE IN THE TREATMENT OF CANCERS UNIV LORRAINE (FR) 2016-10-05 EP disclosed
EP-2838899-A1 THIAZOLIDINEDIONE DERIVATIVES, PREPARATION THEREOF AND USE THEREOF IN CANCER TREATMENT Université de Lorraine (FR) 2015-02-25 EP disclosed
WO-2013110796-A1 THIAZOLIDINEDIONE DERIVATIVES, PREPARATION THEREOF AND USE THEREOF IN CANCER TREATMENT UNIVERSITÉ DE LORRAINE (FR) 2013-08-01 WO disclosed
WO-2002076938-A2 CARBOXYBENZOPYRAN DERIVATIVES AND COMPOSITIONS SONUS PHARMACEUTICALS, INC. (US) 2002-10-03 WO disclosed
US-6413962-B1 ANESTHESIA AND TEMPERATURES REDUCTION; ALPHA-ADRENOCEPTOR AGONIST; RESTORATIVE TO CENTRAL NERVOUS SYSTEM, ESPECIALLY MOTOR AND SENSORY FUNCTIONAL LOSSES FROM TRAMATIC SPINAL CORD INJURIES; ANTISPASTICS; NONSEDATIVE; SIDE EFFECT REDUCTION NAFTCHI N ERIC (US) 2002-07-02 US disclosed
EP-1216026-A1 COMPOSITIONS OF TOCOL-SOLUBLE THERAPEUTICS SONUS PHARMACEUTICALS, INC. (US) 2002-06-26 EP disclosed
WO-2002026208-A2 EMULSION VEHICLE FOR POORLY SOLUBLE DRUGS SONUS PHARMACEUTICALS, INC. (US) 2002-04-04 WO disclosed
WO-2002026324-A2 TOCOL-BASED COMPOSITIONS CONTAINING AMIODARONE SONUS PHARMACEUTICALS, INC. (US) 2002-04-04 WO disclosed
WO-2001022937-A1 COMPOSITIONS OF TOCOL-SOLUBLE THERAPEUTICS SONUS PHARMACEUTICALS, INC. (US) 2001-04-05 WO disclosed
EP-0398132-A2 Phosphorous compounds F. HOFFMANN-LA ROCHE AG (CH) 1990-11-22 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 (1 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-20040053993-A1 Compositions of tocol-soluble therapeutics TTPA, SLC25A13, PCTP PTGS1 863/4885PTGS2 820/4885CYP1A2 4493/4885

“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.