SCHEMBL9253766

SCHEMBL9253766

Cc1c(C)c2c(c(C)c1O)CCC(C)(C(=O)Nc1ccccc1)O2

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.66
PTGS2 P35354 1/20 0.66
CYP1A2 P05177 1/20 0.66
CYP3A4 P08684 1/20 0.66
TSHR P16473 1/20 0.66
ACHE P22303 13/20 0.54
BCHE P06276 12/20 0.54
MAOB P27338 1/20 0.50
TTPA P49638 2/20 0.47
LMNA P02545 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
SCHEMBL30463821 1.00 PTGS1 (0.66) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL9656754 1.00 PTGS1 (0.66) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL9313643 1.00 PTGS1 (0.66) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL20764447 0.90 PTGS1 (0.62) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL4317784 0.88 PTGS1 (0.60) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL15820196 0.88 PTGS1 (0.60) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL9688177 0.88 PTGS1 (0.60) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL8542430 0.87 PTGS1 (0.57) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL9312815 0.87 PTGS1 (0.58) PTGS1PTGS2CYP1A2CYP3A4TSHR
SCHEMBL15820661 0.85 PTGS1 (0.56) PTGS1PTGS2CYP1A2CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210128523-A1 MEDICAMENTS FOR THE TREATMENT OF VASOCONSTRICTION RELATED DISEASES OR DISORDERS SULFATEQ B.V. (NL) 2021-05-06 US claimed
US-20200206235-A1 6-CHROMANOL DERIVATIVES FOR USE AS A MEDICAMENT SULFATEQ B.V. (NL) 2020-07-02 US claimed
EP-3672593-A1 MEDICAMENTS FOR THE TREATMENT OF VASOCONSTRICTION RELATED DISEASES OR DISORDERS Sulfateq B.V. (NL) 2020-07-01 EP claimed
EP-3672592-A1 6-CHROMANOL DERIVATIVES FOR USE AS A MEDICAMENT Sulfateq B.V. (NL) 2020-07-01 EP claimed
WO-2019038360-A1 6-CHROMANOL DERIVATIVES FOR USE AS A MEDICAMENT SULFATEQ B.V. (NL) 2019-02-28 WO claimed
WO-2019038361-A1 MEDICAMENTS FOR THE TREATMENT OF VASOCONSTRICTION RELATED DISEASES OR DISORDERS SULFATEQ B.V. (NL) 2019-02-28 WO claimed
US-5315017-A Peroxidation and eicosanoid biosynthesis inhibition ADIR ET COMPAGNIE (FR) 1994-05-24 US claimed
EP-0487510-A1 Pharmaceutically active amines THE UPJOHN COMPANY (US) 1992-05-27 EP claimed
EP-0358676-A1 PHARMACEUTICALLY ACTIVE AMINES THE UPJOHN COMPANY (US) 1990-03-21 EP claimed
EP-0293078-A1 Pharmaceutically active amines THE UPJOHN COMPANY (US) 1988-11-30 EP claimed
WO-1988008424-A1 PHARMACEUTICALLY ACTIVE AMINES THE UPJOHN COMPANY (US) 1988-11-03 WO claimed
US-12156862-B2 Medicaments for the treatment of vasoconstriction related diseases or disorders SULFATEQ B.V. (NL) 2024-12-03 US disclosed
US-12156862-B2 Medicaments for the treatment of vasoconstriction related diseases or disorders SULFATEQ B.V. (NL) 2024-12-03 US disclosed
US-11730741-B2 6-chromanol derivatives for use as a medicament SULFATEQ B.V. (NL) 2023-08-22 US disclosed
US-11730741-B2 6-chromanol derivatives for use as a medicament SULFATEQ B.V. (NL) 2023-08-22 US disclosed
WO-2019038361-A1 MEDICAMENTS FOR THE TREATMENT OF VASOCONSTRICTION RELATED DISEASES OR DISORDERS SULFATEQ B.V. (NL) 2019-02-28 WO disclosed
US-5395834-A Antiarthritic agents or cardiovascular disorders ADIR ET COMPAGNIE (FR) 1995-03-07 US disclosed
US-5393775-A Administering a (2-chromanyl)alkylcarboxylic acid for disorders connected with peroxidation processes ADIR ET COMPAGNIE (FR) 1995-02-28 US disclosed
US-5315017-A Peroxidation and eicosanoid biosynthesis inhibition ADIR ET COMPAGNIE (FR) 1994-05-24 US disclosed
EP-0512899-A1 Benzopyran compounds, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-11-11 EP disclosed