SCHEMBL14449262

SCHEMBL14449262

CCOC(=O)COc1ccc(SCCCc2sc3ccc(Br)cc3c2C)cc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 3/20 0.39
POLB P06746 4/20 0.38
PABPC1 P11940 1/20 0.38
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
F9 P00740 1/20 0.38
ESR1 P03372 1/20 0.37
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 8/20 0.36
HPGD P15428 5/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
NPSR1 Q6W5P4 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 3/20 0.34
KDM4E B2RXH2 3/20 0.34
PPARG P37231 1/20 0.34

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
SCHEMBL14449264 0.93 PPARD (0.39) PPARDPOLBPABPC1APOBEC3AAPOBEC3G
SCHEMBL4654035 0.90 PPARD (0.49) PPARDMEN1KMT2AALDH1A1HPGD
SCHEMBL14449263 0.87 PPARD (0.45) PPARDESR1PPARGPPARA
SCHEMBL4654269 0.83 PPARD (0.49) PPARDMEN1KMT2AALDH1A1HPGD
SCHEMBL14017062 0.79 PPARD (0.41) PPARDF9ESR1PTGDR2PPARG
SCHEMBL4655286 0.77 PPARD (0.55) PPARDPPARGPPARA
SCHEMBL3587513 0.76 ESR1 (0.48) PPARDESR1MEN1KMT2AALDH1A1
SCHEMBL14016243 0.75 PPARD (0.42) PPARDESR1PPARGPPARA
SCHEMBL3680656 0.75 ESR1 (0.49) PPARDESR1MEN1KMT2AALDH1A1
SCHEMBL14449268 0.74 PPARD (0.41) PPARDF9ESR1PTGDR2PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070155805-A1 Benzofuran and bezothiophene derivatives useful for the treatment of cardiovascular disease SMITHKLINE BEECHAM CORPORATION 2007-07-05 US disclosed
US-20070155805-A1 Benzofuran and bezothiophene derivatives useful for the treatment of cardiovascular disease SMITHKLINE BEECHAM CORPORATION 2007-07-05 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-20070155805-A1 Benzofuran and bezothiophene derivatives useful for the treatment of cardiovascular disease ABAT, BPTF, TNNT2 PPARD 47/4885POLB 2654/4885PABPC1 1221/4885

“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.