SCHEMBL158651

SCHEMBL158651

O=C(OC(=O)n1cccc1)n1cccc1

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.33

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
SCHEMBL27420467 0.80 HSD17B10 (0.44)
SCHEMBL568621 0.77
SCHEMBL3707993 0.77
Methane SCHEMBL11818903 0.75 LPO (0.38) FBP1
Hydrochloric Acid SCHEMBL28011771 0.75 LPO (0.38) FBP1
SCHEMBL28171145 0.73
SCHEMBL1109685 0.73 ALDH1A1 (0.43)
SCHEMBL28849467 0.71
SCHEMBL421871 0.71 BCHE (0.42)
SCHEMBL30173712 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210336268-A1 METHOD AND SYSTEM FOR FUNCTIONAL CONDUCTIVE POLYMER INITIATED CATHODE ELECTROLYTE INTERFACE FOR SILICON ANODE-BASED LITHIUM ION BATTERIES ENEVATE CORPORATION 2021-10-28 US claimed
EP-2170897-B1 METHODS FOR ONE-POT N-DEMETHYLATION/N-ACYLATION OF MORPHINE AND TROPANE ALKALOIDS UNIV BROCK (CA) 2013-08-21 EP claimed
US-7999104-B2 Methods for one-pot N-demethylation/N-acylation of morphine and tropane alkaloids BROCK UNIVERSITY (CA) 2011-08-16 US claimed
CN-101801978-A Methods for one-pot N-demethylation/N-acylation of morphine and tropane alkaloids UNIV BROCK 2010-08-11 CN claimed
EP-2170897-A1 METHODS FOR ONE-POT N-DEMETHYLATION/N-ACYLATION OF MORPHINE AND TROPANE ALKALOIDS Brock University (CA) 2010-04-07 EP claimed
WO-2009003270-A1 METHODS FOR ONE-POT N-DEMETHYLATION/N-ACYLATION OF MORPHINE AND TROPANE ALKALOIDS BROCK UNIVERSITY (CA) 2009-01-08 WO claimed
US-20090005565-A1 METHODS FOR ONE-POT N-DEMETHYLATION/N-ACYLATION OF MORPHINE AND TROPANE ALKALOIDS BROCK UNIVERSITY 2009-01-01 US claimed
US-11777098-B2 Method and system for functional conductive polymer initiated cathode electrolyte interface for silicon anode-based lithium ion batteries ENEVATE CORPORATION (US) 2023-10-03 US disclosed
US-11777098-B2 Method and system for functional conductive polymer initiated cathode electrolyte interface for silicon anode-based lithium ion batteries ENEVATE CORPORATION (US) 2023-10-03 US disclosed
US-11777098-B2 Method and system for functional conductive polymer initiated cathode electrolyte interface for silicon anode-based lithium ion batteries ENEVATE CORPORATION (US) 2023-10-03 US disclosed
US-20210336268-A1 METHOD AND SYSTEM FOR FUNCTIONAL CONDUCTIVE POLYMER INITIATED CATHODE ELECTROLYTE INTERFACE FOR SILICON ANODE-BASED LITHIUM ION BATTERIES ENEVATE CORPORATION 2021-10-28 US disclosed
US-20210336268-A1 METHOD AND SYSTEM FOR FUNCTIONAL CONDUCTIVE POLYMER INITIATED CATHODE ELECTROLYTE INTERFACE FOR SILICON ANODE-BASED LITHIUM ION BATTERIES ENEVATE CORPORATION 2021-10-28 US disclosed
EP-2459565-B1 SAXITOXIN DERIVATIVES, METHODS AND COMPOSITIONS FOR STUDYING, IMAGING, AND TREATING PAIN UNIV LELAND STANFORD JUNIOR (US) 2018-05-02 EP disclosed
CN-1120153-C Pyrrolylidenemethyl derivatives and process for preparing same PHARMACIA S A P (IT) 2003-09-03 CN disclosed
EP-0686147-B1 NOVEL 2,2'-BI-1H-PYRROLE DERIVATIVES WITH IMMUNOSUPPRESSANT ACTIVITY PHARMACIA ITALIA SPA (IT) 2002-09-25 EP disclosed
EP-1241162-A1 2,2'-bi-1H-pyrrole derivatives with immunosuppressant activity Pharmacia Italia S.p.A. (IT) 2002-09-18 EP disclosed
US-5691334-A IMMUNOMODULATORS FOR SKIN GRAFTS, AUTOIMMUNE AND FOR ORGAN TRANSPLANTS PHARMACIA & UPJOHN S.P.A. (IT) 1997-11-25 US disclosed
CN-1118164-A Novel 2,2'-BI-1H-pyrrole derivatives with immunosuppressant activity PHARMACIA SPA (IT) 1996-03-06 CN disclosed
EP-0686147-A1 NOVEL 2,2'-BI-1H-PYRROLE DERIVATIVES WITH IMMUNOSUPPRESSANT ACTIVITY PHARMACIA & UPJOHN S.p.A. (IT) 1995-12-13 EP disclosed
WO-1995017381-A1 NOVEL 2,2'-BI-1H-PYRROLE DERIVATIVES WITH IMMUNOSUPPRESSANT ACTIVITY PHARMACIA S.P.A. (IT) 1995-06-29 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 (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-20090005565-A1 METHODS FOR ONE-POT N-DEMETHYLATION/N-ACYLATION OF MORPHINE AND TROPANE ALKALOIDS HNMT, PNMT, NNMT FBP1 4868/4885

“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.