SCHEMBL2174247

SCHEMBL2174247

COC(=O)Cc1cc(O)c2cc(OC)c(OC)cc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 1/20 0.51
GAA P10253 5/20 0.45
ALDH1A1 P00352 4/20 0.44
GFER P55789 1/20 0.44
HMGCR P04035 3/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
TRPV1 Q8NER1 3/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SENP7 Q9BQF6 3/20 0.38
SENP6 Q9GZR1 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
APAF1 O14727 2/20 0.38
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
ALOX5 P09917 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL2176876 0.79 CYP11B1 (0.51) HSP90AB1GAAALDH1A1GFERCYP3A4
SCHEMBL11467699 0.78 HSP90AB1 (0.50) HSP90AB1GAAALDH1A1GFERTSHR
SCHEMBL2171906 0.78 HSP90AB1 (0.50) HSP90AB1GAAALDH1A1GFERTSHR
SCHEMBL27964303 0.78 GAA (0.41) GAAALDH1A1HMGCRCYP3A4CYP2C9
SCHEMBL1011093 0.78 GAA (0.73) HSP90AB1GAAALDH1A1GFERCYP3A4
SCHEMBL2171172 0.77 HSP90AB1 (0.53) HSP90AB1GAAALDH1A1GFERTSHR
SCHEMBL2175327 0.77 HSP90AB1 (0.49) HSP90AB1GAAALDH1A1GFERTSHR
SCHEMBL2174233 0.77 HSP90AB1 (0.49) HSP90AB1GAAALDH1A1GFERTSHR
SCHEMBL4545435 0.75 HSP90AB1 (0.63) HSP90AB1GAAALDH1A1GFERTRPV1
SCHEMBL3456779 0.75 HSP90AB1 (0.63) HSP90AB1GAAALDH1A1GFERCYP3A4

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-8642629-B2 Naphthylacetic acids HOFFMANN-LA ROCHE INC. (US) 2014-02-04 US disclosed
EP-2346819-B1 NAPHTHYLACETIC ACIDS HOFFMANN LA ROCHE (CH) 2013-04-10 EP disclosed
EP-2346819-A1 NAPHTHYLACETIC ACIDS F. Hoffmann-La Roche AG (CH) 2011-07-27 EP disclosed
WO-2010055004-A1 NAPHTHYLACETIC ACIDS F. HOFFMANN-LA ROCHE AG (CH) 2010-05-20 WO disclosed
US-20100125058-A1 NAPHTHYLACETIC ACIDS CHEN LI 2010-05-20 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-20100125058-A1 NAPHTHYLACETIC ACIDS HRH2, HRH1, HRH3 HSP90AB1 4290/4885GAA 671/4885ALDH1A1 746/4885

“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.