SCHEMBL6174381

SCHEMBL6174381

O=c1cc(O)cc(CCc2ccccc2)o1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 4/20 0.54
HTR3A P46098 1/20 0.54
HSD17B3 P37058 2/20 0.52
PPARG P37231 3/20 0.51
DAO P14920 2/20 0.51
GPR84 Q9NQS5 4/20 0.49
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA3 P07451 1/20 0.45
CA4 P22748 1/20 0.45
CA5A P35218 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
CA5B Q9Y2D0 1/20 0.45
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
SLC5A1 P13866 1/20 0.42
SLC5A2 P31639 1/20 0.42

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
SCHEMBL8116893 0.90 HTR2B (0.56) HTR2BHTR3AHSD17B3PPARGDAO
SCHEMBL21317639 0.88 HTR2B (0.54) HTR2BHTR3AHSD17B3CA2GAA
SCHEMBL6174115 0.84 HSD17B3 (0.51) HSD17B3GAAMAPT
SCHEMBL19679883 0.80 ALOX15 (0.47) HTR2BGAAMAPT
SCHEMBL31733931 0.76 CYP3A4 (0.47) HSD17B3CA12CA2CA9GAA
Dihydro-5,6-Dehydrokawain SCHEMBL19679894 0.76 PPARG (0.59) HTR2BHTR3APPARGCA12CA1
SCHEMBL28489823 0.75 PPARG (0.55) HTR2BHTR3AHSD17B3PPARGDAO
SCHEMBL3700781 0.74 MEN1 (0.50) HSD17B3CA9GAAMAPT
SCHEMBL7959794 0.74 CALM1 (0.57)
SCHEMBL9026440 0.74 CA12 (0.50) HTR2BHTR3AHSD17B3PPARGDAO

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
CN-115011576-B Aquilaria sinensis-derived III-type polyketide synthase AsPKS, and encoding gene and application thereof 中国医学科学院药用植物研究所 2024-10-25 CN claimed
CN-114990084-B Aquilaria sinensis-derived III-type polyketide synthase AsPKS4, and encoding gene and application thereof 中国医学科学院药用植物研究所 2024-08-23 CN claimed
CN-115011576-A Aquilaria sinensis-derived III-type polyketide synthase AsPKS5, and coding gene and application thereof 中国医学科学院药用植物研究所 2022-09-06 CN claimed
CN-114990084-A Aquilaria sinensis-derived III-type polyketide synthase AsPKS4, and coding gene and application thereof 中国医学科学院药用植物研究所 2022-09-02 CN claimed
EP-4702039-A1 METHOD OF PRODUCING STYRYLPYRONES AND CHALCONES Nicoventures Trading Limited (GB) 2026-03-04 EP disclosed
WO-2024224080-A1 METHOD OF PRODUCING STYRYLPYRONES AND CHALCONES Nicoventures Trading Limited (GB) 2024-10-31 WO disclosed
CN-115011576-B Aquilaria sinensis-derived III-type polyketide synthase AsPKS, and encoding gene and application thereof 中国医学科学院药用植物研究所 2024-10-25 CN disclosed
CN-114990084-B Aquilaria sinensis-derived III-type polyketide synthase AsPKS4, and encoding gene and application thereof 中国医学科学院药用植物研究所 2024-08-23 CN disclosed
CN-115011576-A Aquilaria sinensis-derived III-type polyketide synthase AsPKS5, and coding gene and application thereof 中国医学科学院药用植物研究所 2022-09-06 CN disclosed
CN-114990084-A Aquilaria sinensis-derived III-type polyketide synthase AsPKS4, and coding gene and application thereof 中国医学科学院药用植物研究所 2022-09-02 CN disclosed
US-10941429-B2 Enzymatic synthesis of kavalactones and flavokavains WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2021-03-09 US disclosed
US-20190271015-A1 ENZYMATIC SYNTHESIS OF KAVALACTONES AND FLAVOKAVAINS WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH 2019-09-05 US disclosed
US-6169181-B1 HUMAN IMMUNODEFICIENCY VIRUS PROTEINASE INHIBITORS PHARMACIA & UPJOHN COMPANY 2001-01-02 US disclosed
US-6114546-A Aminomethylene derivatives and ultraviolet absorbent comprising thereof CHEMIPRO KASEI KAISHA, LIMITED (JP) 2000-09-05 US disclosed
EP-0950655-A1 AMINOMETHYLENE DERIVATIVES AND ULTRAVIOLET ABSORBER COMPRISING THE SAME CHEMIPRO KASEI KAISHA, LIMITED (JP) 1999-10-20 EP disclosed
US-5852195-A Pyranone compounds useful to treat retroviral infections PHARMACIA & UPJOHN COMPANY (US) 1998-12-22 US disclosed
EP-0758327-A1 PYRANONE COMPOUNDS USEFUL TO TREAT RETROVIRAL INFECTIONS PHARMACIA & UPJOHN COMPANY (US) 1997-02-19 EP disclosed
WO-1995030670-A2 PYRANONE COMPOUNDS USEFUL TO TREAT RETROVIRAL INFECTIONS PHARMACIA & UPJOHN COMPANY (US) 1995-11-16 WO disclosed
EP-0668860-A1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES PHARMACIA & UPJOHN COMPANY (US) 1995-08-30 EP disclosed
WO-1994011361-A1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES THE UPJOHN COMPANY (US) 1994-05-26 WO disclosed