SCHEMBL1914725

SCHEMBL1914725

COC(=O)C(=Cc1ccccc1)CC(=O)OCC(C)C

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
RECQL P46063 1/20 0.44
ALDH1A1 P00352 3/20 0.43
TSHR P16473 1/20 0.43
HPGD P15428 1/20 0.39
CACNA1F O60840 1/20 0.39
CACNA1D Q01668 1/20 0.39
CACNA1S Q13698 1/20 0.39
CACNA1C Q13936 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
LMNA P02545 1/20 0.37
MME P08473 2/20 0.37

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
SCHEMBL7377043 0.84 RECQL (0.53) MEN1KMT2ARECQLCYP3A4CYP2C9
SCHEMBL7431926 0.84 RECQL (0.53) MEN1KMT2ARECQLCYP3A4CYP2C9
SCHEMBL7377051 0.84 RECQL (0.53) MEN1KMT2ARECQLCYP3A4CYP2C9
SCHEMBL7471879 0.82 KMT2A (0.45) MEN1KMT2ARECQLALDH1A1TSHR
SCHEMBL7471890 0.82 KMT2A (0.45) MEN1KMT2ARECQLALDH1A1TSHR
SCHEMBL7471887 0.82 KMT2A (0.45) MEN1KMT2ARECQLALDH1A1TSHR
SCHEMBL10451720 0.81 RECQL (0.50) MEN1KMT2ARECQLCYP3A4CYP2C9
SCHEMBL10451721 0.81 RECQL (0.50) MEN1KMT2ARECQLCYP3A4CYP2C9
SCHEMBL4298396 0.79 TUBB1 (0.47) LMNA
SCHEMBL1915837 0.79 RECQL (0.69) MEN1KMT2ARECQLCYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-09-22 US disclosed
EP-2364297-A1 Compounds, pharmaceutical composition and methods for use in treating metabolic disorders Euroscreen S.A. (BE) 2011-09-14 EP disclosed
WO-2011076734-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING INFLAMMATORY DISEASES EUROSCREEN S.A. (BE) 2011-06-30 WO disclosed
WO-2011076732-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING GASTROINTESTINAL DISORDERS EUROSCREEN S.A. (BE) 2011-06-30 WO disclosed
WO-2010066682-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2010-06-17 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-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS CPT1A, LIPC, PC MEN1 1084/4885KMT2A 3648/4885RECQL 1602/4885

“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.