SCHEMBL5268465

SCHEMBL5268465

CCCCOc1cccc(C(=O)CCCC(=O)OCC)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.59
THRA P10827 1/20 0.59
L3MBTL1 Q9Y468 3/20 0.52
KMT2A Q03164 1/20 0.51
SMPD1 P17405 3/20 0.51
PLA2G4B P0C869 1/20 0.51
CYSLTR2 Q9NS75 1/20 0.49
CYSLTR1 Q9Y271 1/20 0.49
MAPT P10636 1/20 0.49
BRD4 O60885 1/20 0.49
NR1H4 Q96RI1 1/20 0.49
PPARG P37231 1/20 0.48
PPARA Q07869 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
NPC1 O15118 1/20 0.48

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
SCHEMBL4667397 0.91 THRA (0.57) THRBTHRAL3MBTL1KMT2ASMPD1
SCHEMBL4666452 0.87 CYSLTR2 (0.54) THRBTHRAL3MBTL1KMT2ASMPD1
SCHEMBL5270021 0.85 THRB (0.63) THRBTHRAL3MBTL1KMT2ASMPD1
SCHEMBL4266606 0.82 HPGD (0.50) THRBTHRAL3MBTL1KMT2AMAPT
SCHEMBL8955658 0.82 CYSLTR2 (0.63) THRBTHRAL3MBTL1SMPD1PLA2G4B
SCHEMBL27586299 0.82 THRA (0.78) THRBTHRAKMT2ASMPD1PLA2G4B
SCHEMBL11112469 0.82 KMT2A (0.50) THRBTHRAL3MBTL1KMT2ASMPD1
SCHEMBL204170 0.82 CYSLTR2 (0.54) L3MBTL1KMT2ASMPD1CYSLTR2CYSLTR1
SCHEMBL3829470 0.81 L3MBTL1 (0.68) THRBTHRAL3MBTL1MAPTNPC1
SCHEMBL5273048 0.81 THRA (0.58) THRBTHRAL3MBTL1SMPD1PLA2G4B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1420771-B9 USE OF TRIFLUOROACETYL ALKYL-SUBSTITUTED PHENYL DERIVATIVES, PHENOL DERIVATIVES, AND BENZOYL DERIVATIVES IN THE TREATMENT AND/OR PROPHYLAXIS OF OBESITY AND ACCOMPANYING DISEASES AND/OR SECONDARY DISEASES SOLVAY PHARM GMBH (DE) 2007-10-17 EP disclosed
EP-1420771-B1 USE OF TRIFLUOROACETYL ALKYL-SUBSTITUTED PHENYL DERIVATIVES, PHENOL DERIVATIVES, AND BENZOYL DERIVATIVES IN THE TREATMENT AND/OR PROPHYLAXIS OF OBESITY AND ACCOMPANYING DISEASES AND/OR SECONDARY DISEASES SOLVAY PHARM GMBH (DE) 2006-09-06 EP disclosed
US-6930207-B2 Trifluoroacetylalkyl-substituted phenyl, phenol and benzoyl compounds and related methods of treatment SOLVAY PHARMACEUTICAL GMBH (DE) 2005-08-16 US disclosed
US-20040214901-A1 Trifluoroacetylalkyl-substituted phenyl, phenol and benzoyl compounds and related methods of treatment SOLVAY PHARMACEUTICALS GMBH (DE) 2004-10-28 US 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 (1 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-20040214901-A1 Trifluoroacetylalkyl-substituted phenyl, phenol and benzoyl compounds and related methods of treatment PNLIP, LIPC, CEL THRB 1332/4885THRA 1949/4885L3MBTL1 1309/4885

“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.