SCHEMBL414250

SCHEMBL414250

CC[C@@H](c1ccccc1)c1c(O)oc2ccccc2c1=O

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 13/20 0.68
NQO1 P15559 2/20 0.51
VKORC1 Q9BQB6 3/20 0.50
HSD17B10 Q99714 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
ALB P02768 1/20 0.50
PCSK7 Q16549 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CYP3A4 P08684 1/20 0.46

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
SCHEMBL1651720 1.00 CYP2C9 (0.68) CYP2C9NQO1VKORC1HSD17B10KDM4E
SCHEMBL1479347 0.85 CYP2C9 (0.73) CYP2C9VKORC1HSD17B10KDM4EALDH1A1
SCHEMBL20806 0.85 CYP2C9 (0.73) CYP2C9VKORC1HSD17B10KDM4EALDH1A1
SCHEMBL136434 0.85 CYP2C9 (0.73) CYP2C9VKORC1HSD17B10KDM4EALDH1A1
Phenprocoumon SCHEMBL24500472 0.81 CYP2C9 (1.00) CYP2C9NQO1VKORC1HSD17B10KDM4E
Phenprocoumon SCHEMBL29392123 0.81 CYP2C9 (1.00) CYP2C9NQO1VKORC1HSD17B10KDM4E
Phenprocoumon SCHEMBL24500477 0.81 CYP2C9 (1.00) CYP2C9NQO1VKORC1HSD17B10KDM4E
Phenprocoumon SCHEMBL43031 0.81 CYP2C9 (1.00) CYP2C9NQO1VKORC1HSD17B10KDM4E
SCHEMBL1649847 0.80 CYP2C9 (0.50) CYP2C9NQO1HSD17B10KDM4EALDH1A1
Phosphoric Acid SCHEMBL28278851 0.80 CYP2C9 (0.66) CYP2C9VKORC1HSD17B10KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4255391-B1 LUMINOL FOR USE IN THE TREATMENT OF SEQUELAE OF A SARS-COV-2 INFECTION METRIOPHARM AG (CH) 2026-05-06 EP claimed
EP-2988817-B1 BALLOON CATHETER INNORA GMBH (DE) 2022-02-16 EP claimed
EP-3721898-B1 SYNTHETIC PEPTIDES, PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME, AND USES THEREOF IN TREATING THROMBOEMBOLISM-RELATED DISEASES ACADEMIA SINICA (TW) 2021-11-10 EP claimed
US-10806908-B2 Balloon catheter INNORA GMBH (DE) 2020-10-20 US claimed
EP-3100728-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING PRASUGREL AND CYCLODEXTRIN DERIVATIVES AND METHODS OF MAKING AND USING THE SAME CYDEX PHARMACEUTICALS INC (US) 2019-11-20 EP claimed
EP-2782564-B1 CYSTEAMINE AND/OR CYSTAMINE FOR TREATING ISCHEMIC INJURY UNIV CALIFORNIA (US) 2019-01-09 EP claimed
EP-2376126-B1 ANTAGONISTS OF IL-6 TO PREVENT OR TREAT THROMBOSIS ALDERBIO HOLDINGS LLC (US) 2017-12-20 EP claimed
EP-2391632-B1 BACTERIOSTATIC CATHETER LOCK CONTAINING GLYCEROL TELEFLEX MEDICAL INC (US) 2017-11-15 EP claimed
EP-1998825-B1 ANTIMICROBIAL COMPOSITIONS AND METHODS FOR LOCKING CATHETERS BECTON DICKINSON CO (US) 2017-10-18 EP claimed
WO-2017140840-A1 DETERMINATION OF CORRECTED DERIVED FIBRINOGEN RESULTS ROCHE DIAGNOSTICS GMBH (DE) 2017-08-24 WO claimed
EP-1408949-A2 GLYCINE BETAINE AND ITS USE AS ANTI-HEMORRHAGIC AGENT Messadek, Jallal (BE) 2004-04-21 EP claimed
US-20040033223-A1 Glycine betaine and its use MESSADEK JALLAL (BE) 2004-02-19 US claimed
US-20030119719-A1 Use of endothelin conjugates in therapy, new endothelin conjugates, agents that contain the latter, and process for their production DINKELBORG LUDGER (DE) 2003-06-26 US claimed
WO-2002062322-A2 GLYCINE BETAINE AND ITS USE AS ANTI-HEMORRHAGIC AGENT MESSADEK JALLAL (BE) 2002-08-15 WO claimed
US-5985915-A CARDIOVASCULAR DISORDERS SUCH AS ARRHYTHMIA SANOFI (FR) 1999-11-16 US claimed
EP-0946205-A2 USE OF ENDOTHELIN CONJUGATES IN THERAPY, NEW ENDOTHELIN CONJUGATES, SUBSTANCES CONTAINING THEM, AND PROCESSES FOR PRODUCING THEM SCHERING AKTIENGESELLSCHAFT (DE) 1999-10-06 EP claimed
WO-1998040067-A1 USE OF BENZOFURAN DERIVATIVES FOR REDUCING DEATH RATE AFTER MYOCARDIAL INFARCTION SANOFI (FR) 1998-09-17 WO claimed
WO-1998024482-A2 USE OF ENDOTHELIN CONJUGATES IN THERAPY, NEW ENDOTHELIN CONJUGATES, SUBSTANCES CONTAINING THEM, AND PROCESSES FOR PRODUCING THEM SCHERING AKTIENGESELLSCHAFT (DE) 1998-06-11 WO claimed
WO-1997034597-A1 USE OF ANTIARRHYTHMIC COMPOUNDS FOR REDUCING POST-INFARCTION MORTALITY SANOFI (FR) 1997-09-25 WO claimed
EP-0796617-A1 Use of antiarhythmic compounds to reduce post-infarct mortality SANOFI (FR) 1997-09-24 EP claimed