SCHEMBL8928418

SCHEMBL8928418

Cc1nnc2n1-c1sc(CCC(=O)O)cc1C(c1ccccc1Cl)=NC2

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 19/20 0.77
CYP3A4 P08684 1/20 0.77
ALOX15 P16050 1/20 0.77
OPRK1 P41145 1/20 0.74
PDE4D Q08499 1/20 0.74

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
Pyrrole SCHEMBL9661972 0.96 PTAFR (0.72) PTAFRCYP3A4ALOX15OPRK1PDE4D
SCHEMBL9662085 0.94 PTAFR (0.72) PTAFRCYP3A4ALOX15OPRK1PDE4D
SCHEMBL9654262 0.94 PTAFR (0.71) PTAFRCYP3A4ALOX15OPRK1PDE4D
SCHEMBL9421185 0.92 PTAFR (0.75) PTAFRCYP3A4ALOX15OPRK1PDE4D
SCHEMBL9661420 0.91 PTAFR (0.65) PTAFRCYP3A4ALOX15OPRK1PDE4D
SCHEMBL9661351 0.91 PTAFR (0.74) PTAFRCYP3A4ALOX15OPRK1PDE4D
SCHEMBL9654348 0.90 PTAFR (0.69) PTAFRCYP3A4ALOX15OPRK1PDE4D
SCHEMBL9654335 0.90 OPRK1 (0.76) PTAFRCYP3A4ALOX15OPRK1PDE4D
SCHEMBL9661918 0.90 PTAFR (0.73) PTAFRCYP3A4ALOX15OPRK1PDE4D
SCHEMBL8928557 0.90 PTAFR (0.73) PTAFRCYP3A4ALOX15OPRK1PDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5334592-A Administering for allergic reactions; thienotriazolodiazepine compounds SCHERING CORPORATION (US) 1994-08-02 US claimed
EP-0345931-B1 CERTAIN PAF ANTAGONIST/ANTIHISTAMINE COMBINATIONS AND METHODS SCHERING CORPORATION (US) 1993-01-20 EP claimed
US-5155103-A Methods of using new thieno-triazole-1,4-diazepino-2-carboxylic acid amides BOEHRINGER INGELHEIM GMBH (DE) 1992-10-13 US claimed
US-5082839-A Platelet activating factor antagonist BOEHRINGER INGELHEIM GMBH (DE) 1992-01-21 US claimed
EP-0402422-A1 CERTAIN PAF ANTAGONIST ANTIHISTAMINE COMBINATIONS AND METHODS SCHERING CORPORATION (US) 1990-12-19 EP claimed
WO-1989010143-A1 CERTAIN PAF ANTAGONIST ANTIHISTAMINE COMBINATIONS AND METHODS SCHERING CORPORATION (US) 1989-11-02 WO claimed
EP-0194416-B1 THIENO-TRIAZOLO-1,4-DIAZEPINO-2-CARBOXAMIDES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM KG (DE) 1989-04-26 EP claimed
EP-0776892-A1 THIENYLAZOLE COMPOUND AND THIENOTRIAZOLODIAZEPINE COMPOUND YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-06-04 EP disclosed
EP-0328924-B1 Thienotriazolodiazepine compounds and pharmaceutical uses thereof YOSHITOMI PHARMACEUTICAL (JP) 1996-08-21 EP disclosed
EP-0342587-B1 Thienotriazolodiazepine compounds and pharmaceutical uses thereof YOSHITOMI PHARMACEUTICAL (JP) 1994-11-17 EP disclosed
US-5334592-A Administering for allergic reactions; thienotriazolodiazepine compounds SCHERING CORPORATION (US) 1994-08-02 US disclosed
EP-0345931-B1 CERTAIN PAF ANTAGONIST/ANTIHISTAMINE COMBINATIONS AND METHODS SCHERING CORPORATION (US) 1993-01-20 EP disclosed
US-5155103-A Methods of using new thieno-triazole-1,4-diazepino-2-carboxylic acid amides BOEHRINGER INGELHEIM GMBH (DE) 1992-10-13 US disclosed
US-4968794-A ANTAGONISTS OF PLATELET ACTIVATING FACTOR BOEHRINGER INGELHEIM KG (DE) 1990-11-06 US disclosed
US-4937240-A PLATELET ACTIVATING FACTOR ANTAGONISTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1990-06-26 US disclosed
US-4910194-A Structure substituted with phenyl group YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1990-03-20 US disclosed
US-4900729-A PLATELET ACTIVATING FACTOR ANTAGONISTS BOEHRINGER INGELHEIM KG (DE) 1990-02-13 US disclosed
WO-1989010143-A1 CERTAIN PAF ANTAGONIST ANTIHISTAMINE COMBINATIONS AND METHODS SCHERING CORPORATION (US) 1989-11-02 WO disclosed
EP-0328924-A2 Thienotriazolodiazepine compounds and pharmaceutical uses thereof Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1989-08-23 EP disclosed
EP-0194416-B1 THIENO-TRIAZOLO-1,4-DIAZEPINO-2-CARBOXAMIDES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM KG (DE) 1989-04-26 EP disclosed