SCHEMBL751348

SCHEMBL751348

C[C@@H]1CC[C@@H]2[C@@H](C1)C[C@H]1C(=O)O[C@H](C)[C@H]1[C@H]2/C=C/c1ccc(-c2cccc(F)c2)cn1

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
F2R P25116 20/20 0.84

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
SCHEMBL14203720 1.00 F2R (0.84) F2R
SCHEMBL12759523 1.00 F2R (0.84) F2R
SCHEMBL13513129 0.92 F2R (1.00) F2R
SCHEMBL14203709 0.92 F2R (1.00) F2R
SCHEMBL13324645 0.92 F2R (1.00) F2R
SCHEMBL12831686 0.92 F2R (0.82) F2R
SCHEMBL11969013 0.92 F2R (1.00) F2R
SCHEMBL15282339 0.92 F2R (1.00) F2R
SCHEMBL11994829 0.92 F2R (1.00) F2R
SCHEMBL11969016 0.92 F2R (1.00) F2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170240539-A1 Preparation and Use of Cyclic Sulfonamide Derivatives as PAR-1 Receptor Antagonists MERCK SHARP & DOHME CORP. (US) 2017-08-24 US disclosed
US-20170224666-A9 IMMEDIATE-RELEASE TABLET FORMULATIONS OF A THROMBIN RECEPTOR ANTAGONIST TOPROL ACQUISITION LLC 2017-08-10 US disclosed
US-20160193196-A1 IMMEDIATE-RELEASE TABLET FORMULATIONS OF A THROMBIN RECEPTOR ANTAGONIST MERCK SHARP & DOHME CORP. (US) 2016-07-07 US disclosed
US-8575351-B2 Active metabolite of a thrombin receptor antagonist MERCK SHARP & DOHME CORP. (US) 2013-11-05 US disclosed
US-8329905-B2 Synthesis of diethyl{[5-(3-fluorophenyl)-pyridine-2yl]methyl}phosphonate MERCK SHARP & DOHME CORP. (US) 2012-12-11 US disclosed
US-20120302745-A1 EXO-SELECTIVE SYNTHESIS OF HIMBACINE ANALOGS THIRUVENGADAM TIRUVETTIPURAM K (US) 2012-11-29 US disclosed
US-8273790-B2 Exo-selective synthesis of himbacine analogs SCHERING CORPORATION (US) 2012-09-25 US disclosed
US-20120214845-A1 ACTIVE METABOLITE OF A THROMBIN RECEPTOR ANTAGONIST TOPROL ACQUISITION LLC 2012-08-23 US disclosed
US-20120142914-A1 EXO-SELECTIVE SYNTHESIS OF HIMBACINE ANALOGS TOPROL ACQUISITION LLC 2012-06-07 US disclosed
US-8138180-B2 Exo-selective synthesis of himbacine analogs SCHERING CORPORATION (US) 2012-03-20 US disclosed
US-7626045-B2 Synthesis of himbacine analogs SCHERING CORPORATION (US) 2009-12-01 US disclosed
US-20090281321-A1 EXO- AND DIASTEREO- SELECTIVE SYNTHESES OF HIMBACINE ANALOGS SCHERING CORPORATION 2009-11-12 US disclosed
US-7605275-B2 Cyclization of 1-(1-(diphenylaminocarbonyl-vinyl-)ethyl-oxycarbonyl-vinyl-),5-nitro-)cyclohex-1-ene by heating in a solvent to form an trans-(5,6)ring junction and an endoisomer(cis) isomer of 3-(oxo),6-(nitro),9-diphenylamido-perhydro-4,4a-didehydronaphtho(2,3)furan SCHERING CORPORATION (US) 2009-10-20 US disclosed
US-20090203925-A1 SYNTHESIS OF HIMBACINE ANALOGS SCHERING CORPORATION 2009-08-13 US disclosed
US-7541471-B2 Synthesis of himbacine analogs SCHERING CORPORATION (US) 2009-06-02 US disclosed
US-20080194560-A1 DISINTEGRATION PROMOTERS IN SOLID DOSE WET GRANULATION FORMULATIONS SCHERING CORPORATION 2008-08-14 US disclosed
US-20080031943-A1 IMMEDIATE-RELEASE TABLET FORMULATIONS OF A THROMBIN RECEPTOR ANTAGONIST TOPROL ACQUISITION LLC 2008-02-07 US disclosed
US-20080026050-A1 SOLID DOSE FORMULATIONS OF A THROMBIN RECEPTOR ANTAGONIST SCHERING CORPORATION 2008-01-31 US disclosed
US-20080004449-A1 Synthesis of diethyl{[5-(3-fluorophenyl)-pyridine-2yl]methyl}phosphonate TOPROL ACQUISITION LLC 2008-01-03 US disclosed
US-20070238674-A1 TRA COMBINATION THERAPIES SCHERING CORPORATION 2007-10-11 US 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 (13 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-20080194560-A1 DISINTEGRATION PROMOTERS IN SOLID DOSE WET GRANULATION FORMULATIONS SP1, TMPRSS2, GPR39 F2R 11/4885
US-20080004449-A1 Synthesis of diethyl{[5-(3-fluorophenyl)-pyridine-2yl]methyl}phosphonate F2, F2R, PTAFR F2R 2/4885
US-20170224666-A9 IMMEDIATE-RELEASE TABLET FORMULATIONS OF A THROMBIN RECEPTOR ANTAGONIST F2R, F2RL1, TBXA2R F2R 1/4885
US-20160193196-A1 IMMEDIATE-RELEASE TABLET FORMULATIONS OF A THROMBIN RECEPTOR ANTAGONIST F2R, F2RL1, TBXA2R F2R 1/4885
US-20080026050-A1 SOLID DOSE FORMULATIONS OF A THROMBIN RECEPTOR ANTAGONIST F2R, F2RL1, TBXA2R F2R 1/4885
US-20080031943-A1 IMMEDIATE-RELEASE TABLET FORMULATIONS OF A THROMBIN RECEPTOR ANTAGONIST F2R, F2RL1, TBXA2R F2R 1/4885
US-20090203925-A1 SYNTHESIS OF HIMBACINE ANALOGS BDKRB1, HTR3B, HTR1B F2R 11/4885
US-20170240539-A1 Preparation and Use of Cyclic Sulfonamide Derivatives as PAR-1 Receptor Antagonists F2R, PRSS1, F2RL1 F2R 1/4885
US-20120214845-A1 ACTIVE METABOLITE OF A THROMBIN RECEPTOR ANTAGONIST F2R, F2RL1, F2RL3 F2R 1/4885
US-20120302745-A1 EXO-SELECTIVE SYNTHESIS OF HIMBACINE ANALOGS CHKB, BDKRB1, EDNRB F2R 70/4885
US-20090281321-A1 EXO- AND DIASTEREO- SELECTIVE SYNTHESES OF HIMBACINE ANALOGS EDNRA, EDNRB, NMBR F2R 24/4885
US-20120142914-A1 EXO-SELECTIVE SYNTHESIS OF HIMBACINE ANALOGS CHKB, BDKRB1, EDNRB F2R 70/4885
US-20070238674-A1 TRA COMBINATION THERAPIES EDNRA, EDNRB, TBXA2R F2R 9/4885

“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.