SCHEMBL16050682

SCHEMBL16050682

CCCCCc1cc(CCCCC)cc(CC(=O)OC)c1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.66
HSP90AB1 P08238 1/20 0.55
PTGS2 P35354 4/20 0.48
CYP3A4 P08684 1/20 0.48
ALDH1A1 P00352 3/20 0.47
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
PPARG P37231 2/20 0.44
PPARA Q07869 2/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
GAA P10253 1/20 0.42
GFER P55789 1/20 0.42
TLR7 Q9NYK1 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
SCHEMBL1628911 0.94 HSP90AB1 (0.67) GPR84HSP90AB1PTGS2CYP3A4
SCHEMBL14420104 0.87 PTGS2 (0.54) GPR84HSP90AB1PTGS2CYP4F2CYP4A11
SCHEMBL1630570 0.87 SLC7A5 (0.54) GPR84CYP4F2CYP4A11PPARGPPARA
SCHEMBL20381252 0.86 GPR84 (0.62) GPR84HSP90AB1PTGS2CYP3A4ALDH1A1
SCHEMBL23521630 0.86 ALDH1A1 (0.66) PTGS2CYP3A4ALDH1A1CYP4F2CYP4A11
SCHEMBL26239996 0.85 PPARA (0.55) GPR84PPARGPPARATLR7
SCHEMBL20381224 0.85 GPR84 (0.60) GPR84PTGS2CYP3A4ALDH1A1PPARG
SCHEMBL26239688 0.84 ALDH1A1 (0.64) PTGS2CYP3A4ALDH1A1CYP4F2CYP4A11
SCHEMBL23167611 0.84 ALDH1A1 (0.64) PTGS2CYP3A4ALDH1A1CYP4F2CYP4A11
SCHEMBL21891794 0.82 HSP90AB1 (0.75) HSP90AB1ALDH1A1CYP4F2CYP4A11GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023076668-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF CANCER BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2023-05-04 WO disclosed
US-11524930-B2 Substituted aromatic compounds and related method for the treatment of fibrosis Liminal Biosciences Limited (GB) 2022-12-13 US disclosed
US-11524930-B2 Substituted aromatic compounds and related method for the treatment of fibrosis Liminal Biosciences Limited (GB) 2022-12-13 US disclosed
US-11185521-B2 Substituted aromatic compounds and pharmaceutical compositions for the prevention and treatment of osteoporosis Liminal Biosciences Limited (GB) 2021-11-30 US disclosed
US-11185521-B2 Substituted aromatic compounds and pharmaceutical compositions for the prevention and treatment of osteoporosis Liminal Biosciences Limited (GB) 2021-11-30 US disclosed
CN-106999458-B Substituted aromatic compounds and pharmaceutical compositions for the prevention and treatment of diabetes 普罗米蒂克医药SMT有限公司 2021-04-13 CN disclosed
US-20210085626-A1 SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR TISSUE SELF-REPAIR AND REGENERATION LIMINAL BIOSCIENCES LTD (GB) 2021-03-25 US disclosed
US-20210085626-A1 SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR TISSUE SELF-REPAIR AND REGENERATION LIMINAL BIOSCIENCES LTD (GB) 2021-03-25 US disclosed
EP-3203998-B1 SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF DIABETES LIMINAL BIOSCIENCES LTD (GB) 2021-03-10 EP disclosed
EP-3203998-B1 SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF DIABETES LIMINAL BIOSCIENCES LTD (GB) 2021-03-10 EP disclosed
WO-2016054728-A1 SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF OSTEOPOROSIS PROMETIC BIOSCIENCES INC. (CA) 2016-04-14 WO disclosed
WO-2016054728-A1 SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF OSTEOPOROSIS PROMETIC BIOSCIENCES INC. (CA) 2016-04-14 WO disclosed
WO-2016054726-A1 SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF DIABETES PROMETIC BIOSCIENCES INC. (CA) 2016-04-14 WO disclosed
WO-2016054726-A1 SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF DIABETES PROMETIC BIOSCIENCES INC. (CA) 2016-04-14 WO disclosed
US-20160039736-A1 Substituted Aromatic Compounds and Related Method for the Treatment of Fibrosis Liminal Biosciences Limited (GB) 2016-02-11 US disclosed
US-20160039736-A1 Substituted Aromatic Compounds and Related Method for the Treatment of Fibrosis Liminal Biosciences Limited (GB) 2016-02-11 US disclosed
US-20160039736-A1 Substituted Aromatic Compounds and Related Method for the Treatment of Fibrosis Liminal Biosciences Limited (GB) 2016-02-11 US disclosed
EP-2970089-A1 SUBSTITUTED AROMATIC COMPOUNDS AND RELATED METHOD FOR THE TREATMENT OF FIBROSIS ProMetic BioSciences Inc. (CA) 2016-01-20 EP disclosed
WO-2014138906-A1 SUBSTITUTED AROMATIC COMPOUNDS AND RELATED METHOD FOR THE TREATMENT OF FIBROSIS PROMETIC BIOSCIENCES INC. (CA) 2014-09-18 WO disclosed
WO-2014138906-A1 SUBSTITUTED AROMATIC COMPOUNDS AND RELATED METHOD FOR THE TREATMENT OF FIBROSIS PROMETIC BIOSCIENCES INC. (CA) 2014-09-18 WO 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 (4 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-20210085626-A1 SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR TISSUE SELF-REPAIR AND REGENERATION COL1A1, CCNH, COL2A1 GPR84 1983/4885HSP90AB1 1789/4885PTGS2 322/4885
US-11524930-B2 Substituted aromatic compounds and related method for the treatment of fibrosis CFH, C5, C9 GPR84 1802/4885HSP90AB1 3052/4885PTGS2 2040/4885
US-20160039736-A1 Substituted Aromatic Compounds and Related Method for the Treatment of Fibrosis CFH, C9, C5 GPR84 2045/4885HSP90AB1 2699/4885PTGS2 2200/4885
US-11185521-B2 Substituted aromatic compounds and pharmaceutical compositions for the prevention and treatment of osteoporosis ADIPOR1, ADIPOR2, FN1 GPR84 632/4885HSP90AB1 4599/4885PTGS2 2609/4885

“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.