SCHEMBL750216

SCHEMBL750216

CCCCCC(C)C(C)CCC

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.52
CA1 P00915 2/20 0.42
SPHK1 Q9NYA1 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.41
THRB P10828 1/20 0.41
DNM1 Q05193 2/20 0.41
TP53 P04637 1/20 0.41
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH4 P08319 1/20 0.39
ADH7 P40394 1/20 0.39
FDPS P14324 1/20 0.39
SMPD1 P17405 3/20 0.38
ACE2 Q9BYF1 1/20 0.38

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
SCHEMBL9178606 0.97 OPRM1 (0.50) OPRM1SPHK1LMNATSHRTHRB
SCHEMBL22982430 0.97 OPRM1 (0.50) OPRM1SPHK1LMNATSHRTHRB
SCHEMBL28161558 0.97 OPRM1 (0.50) OPRM1SPHK1LMNATSHRTHRB
SCHEMBL13858888 0.94 OPRM1 (0.58) OPRM1CA1SPHK1LMNATSHR
SCHEMBL6531560 0.90 DNM1 (0.43) OPRM1CA1LMNATSHRTHRB
SCHEMBL13858988 0.90 OPRM1 (0.55) OPRM1SPHK1LMNATSHRTHRB
SCHEMBL31169240 0.90 OPRM1 (0.55) OPRM1SPHK1LMNATSHRTHRB
SCHEMBL10657571 0.90 OPRM1 (0.55) OPRM1SPHK1LMNATSHRTHRB
SCHEMBL11480610 0.90 OPRM1 (0.55) OPRM1SPHK1LMNATSHRTHRB
SCHEMBL325629 0.90 OPRM1 (0.55) OPRM1SPHK1LMNATSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2968342-A1 COMPOSITIONS COMPRISING THIENOPYRIMIDINE AND THIENOPYRIDINE COMPOUNDS AND METHODS OF USE THEREOF The Regents Of The University Of Michigan (US) 2016-01-20 EP claimed
CN-105188705-A Compositions comprising thienopyrimidine and thienopyridine compounds and methods of use thereof UNIV MICHIGAN 2015-12-23 CN claimed
WO-2014164543-A1 COMPOSITIONS COMPRISING THIENOPYRIMIDINE AND THIENOPYRIDINE COMPOUNDS AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-10-09 WO claimed
US-20200171214-A1 BIORESORBABLE SURFACE COATING FOR DELAYING DEGRADATION DREI LILIEN PVG GMBH & CO. KG (DE) 2020-06-04 US disclosed
EP-3648806-A1 BIORESORBABLE SURFACE COATING FOR DELAYING DEGRADATION Drei Lilien PVG GmbH & Co. KG (DE) 2020-05-13 EP disclosed
WO-2019008192-A1 BIORESORBABLE SURFACE COATING FOR DELAYING DEGRADATION DREI LILIEN PVG GMBH & CO. KG (DE) 2019-01-10 WO disclosed
US-10160769-B2 Compositions comprising thienopyrimidine and thienopyridine compounds and methods of use thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2018-12-25 US disclosed
EP-2968342-B1 COMPOSITIONS COMPRISING THIENOPYRIMIDINE AND THIENOPYRIDINE COMPOUNDS AND METHODS OF USE THEREOF UNIV MICHIGAN REGENTS (US) 2018-10-03 EP disclosed
US-20170253611-A1 COMPOSITIONS COMPRISING THIENOPYRIMIDINE AND THIENOPYRIDINE COMPOUNDS AND METHODS OF USE THEREOF THE LEUKEMIA & LYMPHOMA SOCIETY, INC. 2017-09-07 US disclosed
US-9505781-B2 Compositions comprising thienopyrimidine and thienopyridine compounds and methods of use thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2016-11-29 US disclosed
WO-2016040330-A1 THIENOPYRIMIDINE AND THIENOPYRIDINE COMPOUNDS AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2016-03-17 WO disclosed
CN-105188705-A Compositions comprising thienopyrimidine and thienopyridine compounds and methods of use thereof UNIV MICHIGAN 2015-12-23 CN disclosed
US-9216993-B2 Compositions comprising thienopyrimidine and thienopyridine compounds and methods of use thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2015-12-22 US disclosed
WO-2014164543-A1 COMPOSITIONS COMPRISING THIENOPYRIMIDINE AND THIENOPYRIDINE COMPOUNDS AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-10-09 WO disclosed
EP-2430133-A1 LUBRICATING COMPOSITION CONTAINING A MALIC ACID DERIVATIVE The Lubrizol Corporation (US) 2012-03-21 EP disclosed
WO-2011149810-A1 LUBRICATING COMPOSITION THE LUBRIZOL CORPORATION (US) 2011-12-01 WO disclosed
EP-2367917-A1 LUBRICATING COMPOSITION CONTAINING A COMPOUND DERIVED FROM A HYDROXY-CARBOXYLIC ACID The Lubrizol Corporation (US) 2011-09-28 EP disclosed
US-20110207635-A1 Lubricating Composition Containing Metal Carboxylate THE LUBRIZOL CORPORATION (US) 2011-08-25 US disclosed
EP-2346967-A1 LUBRICATING COMPOSITION CONTAINING METAL CARBOXYLATE The Lubrizol Corporation (US) 2011-07-27 EP disclosed
WO-2011034829-A1 LUBRICATING COMPOSITION CONTAINING AN ESTER THE LUBRIZOL CORPORATION (US) 2011-03-24 WO 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-10160769-B2 Compositions comprising thienopyrimidine and thienopyridine compounds and methods of use thereof MLLT1, MLLT3, BMI1 OPRM1 4679/4885CA1 3322/4885SPHK1 2575/4885
US-20170253611-A1 COMPOSITIONS COMPRISING THIENOPYRIMIDINE AND THIENOPYRIDINE COMPOUNDS AND METHODS OF USE THEREOF MLLT1, MLLT3, BMI1 OPRM1 4679/4885CA1 3322/4885SPHK1 2575/4885

“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.