SCHEMBL4667397

SCHEMBL4667397

CCCC(=O)c1cccc(OCCCC(=O)OCC)c1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.57
THRB P10828 1/20 0.57
CYSLTR2 Q9NS75 2/20 0.53
CYSLTR1 Q9Y271 2/20 0.53
KMT2A Q03164 1/20 0.52
FAAH O00519 1/20 0.50
BRD4 O60885 1/20 0.50
SMPD1 P17405 3/20 0.49
PDK2 Q15119 1/20 0.47
PLA2G4B P0C869 1/20 0.46
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
MMP13 P45452 1/20 0.46
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL5268465 0.91 THRB (0.59) THRATHRBCYSLTR2CYSLTR1KMT2A
SCHEMBL4666452 0.91 CYSLTR2 (0.54) THRATHRBCYSLTR2CYSLTR1KMT2A
SCHEMBL204170 0.85 CYSLTR2 (0.54) CYSLTR2CYSLTR1KMT2AFAAHBRD4
SCHEMBL4266606 0.83 HPGD (0.50) THRATHRBKMT2ATDP1L3MBTL1
SCHEMBL3814672 0.83 L3MBTL1 (0.63) THRATHRBCYSLTR2CYSLTR1BRD4
SCHEMBL8955658 0.83 CYSLTR2 (0.63) THRATHRBCYSLTR2CYSLTR1FAAH
SCHEMBL11112469 0.83 KMT2A (0.50) THRATHRBCYSLTR2CYSLTR1KMT2A
SCHEMBL10054169 0.82 L3MBTL1 (0.62) CYSLTR2CYSLTR1KMT2AFAAHBRD4
SCHEMBL4665843 0.81 ESR1 (0.53) CYSLTR2CYSLTR1KMT2ABRD4
SCHEMBL9968921 0.81 TDP1 (0.54) CYSLTR2CYSLTR1KMT2AFAAHBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators KATAMREDDY SUBBA REDDY 2008-10-16 US disclosed
EP-1951216-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2008-08-06 EP disclosed
WO-2007062145-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-05-31 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 (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-20080255078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators GPER1, ESR2, ESRRG THRA 62/4885THRB 54/4885CYSLTR2 587/4885

“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.