SCHEMBL274698

SCHEMBL274698

CC(C)(C)[Si](C)(C)OCCOc1ccc(Oc2ccc(F)cc2C=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.41
PPARG P37231 5/20 0.39
PPARD Q03181 5/20 0.39
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
SCN8A Q9UQD0 1/20 0.36
SCN10A Q9Y5Y9 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL275136 0.86 ALDH1A1 (0.41) PPARAALDH1A1MAPTLMNACYP1A2
SCHEMBL275040 0.86 ALDH1A1 (0.34) PPARAALDH1A1MAPTLMNACYP1A2
SCHEMBL13815387 0.82 ALDH1A1 (0.46) PPARAALDH1A1MAPTLMNACYP1A2
SCHEMBL18570917 0.80 SCN8A (0.51) PPARAPPARGPPARDALDH1A1MAPT
SCHEMBL275811 0.80 PPARA (0.36) PPARAPPARGPPARDALDH1A1MAPT
SCHEMBL279111 0.80 PPARA (0.36) PPARAPPARGPPARDALDH1A1MAPT
SCHEMBL29043269 0.78 HTR2C (0.34) PPARAALDH1A1MAPTCYP1A2CYP2C19
SCHEMBL18570379 0.78 CACNA1C (0.50) ALDH1A1MAPTLMNACYP1A2CYP2C9
SCHEMBL18570388 0.77 SCN8A (0.53) PPARAPPARGPPARDALDH1A1MAPT
SCHEMBL17558158 0.77 TUBB1 (0.41) PPARGALDH1A1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8134001-B2 Spiroindolinone derivatives HOFFMANN-LA ROCHE INC. (US) 2012-03-13 US disclosed
US-8134001-B2 Spiroindolinone derivatives HOFFMANN-LA ROCHE INC. (US) 2012-03-13 US disclosed
EP-2229396-B1 SPIROINDOLINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-08-10 EP disclosed
EP-2229396-A1 SPIROINDOLINONE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2010-09-22 EP disclosed
WO-2009077357-A1 SPIROINDOLINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-25 WO disclosed
US-20090156610-A1 Spiroindolinone Derivatives DING QINGJIE 2009-06-18 US disclosed
US-20090156610-A1 Spiroindolinone Derivatives DING QINGJIE 2009-06-18 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-20090156610-A1 Spiroindolinone Derivatives SDHA, AR, XPOT PPARA 369/4885PPARG 460/4885PPARD 490/4885

“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.