SCHEMBL2946934

SCHEMBL2946934

CCOC(=O)Cc1ccc(C)c(CO)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.47
CYP4A11 Q02928 3/20 0.47
CYP4Z1 Q86W10 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
PKM P14618 2/20 0.45
NPC1 O15118 1/20 0.45
NFKB1 P19838 1/20 0.45
RAB9A P51151 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 2/20 0.43
LMNA P02545 3/20 0.42
YWHAG P61981 1/20 0.41
F2 P00734 1/20 0.40
NLRP3 Q96P20 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL16803510 0.89 CYP4F2 (0.46) CYP4F2CYP4A11CYP4Z1SMN1; SMN2PKM
SCHEMBL14632173 0.87 PKM (0.50) CYP4F2CYP4A11CYP4Z1SMN1; SMN2PKM
SCHEMBL13492095 0.84 MEN1 (0.49) CYP4F2CYP4A11CYP4Z1SMN1; SMN2PKM
SCHEMBL20289308 0.84 CYP4F2 (0.64) CYP4F2CYP4A11CYP4Z1SMN1; SMN2LMNA
SCHEMBL1008790 0.81 YWHAG (0.53) CYP4F2CYP4A11CYP4Z1SMN1; SMN2PKM
SCHEMBL13492094 0.81 CYP4Z1 (0.47) CYP4F2CYP4A11CYP4Z1SMN1; SMN2PKM
SCHEMBL9883941 0.81 CYP4F2 (0.44) CYP4F2CYP4A11CYP4Z1SMN1; SMN2PKM
SCHEMBL6207253 0.80 CYP4Z1 (0.55) CYP4F2CYP4A11CYP4Z1SMN1; SMN2PKM
SCHEMBL26534252 0.80 YWHAG (0.46) CYP4F2CYP4A11CYP4Z1SMN1; SMN2PKM
SCHEMBL12900615 0.80 CYP4Z1 (0.46) CYP4F2CYP4A11CYP4Z1SMN1; SMN2PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1842923-B1 Methanesulfonylaminoindole derivatives and labeled oligonucleotide probes containing them ROCHE DIAGNOSTICS GMBH (DE) 2015-07-15 EP disclosed
US-7759470-B2 Labeling reagent ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2010-07-20 US disclosed
EP-1842923-A1 Methanesulfonylaminoindole derivatives and labeled oligonucleotide probes containing them. Roche Diagnostics GmbH (DE) 2007-10-10 EP disclosed
US-20070196852-A1 Labeling reagent ROCHE DIAGNOSTICS GMBH (DE) 2007-08-23 US disclosed
US-20040235022-A1 Quality control method for manufacturing biopolymer arrays ROCHE DIAGNOSTICS GMBH (DE) 2004-11-25 US disclosed
EP-1466663-A1 Quality control method for manufacturing nucleic acid arrays F. HOFFMANN-LA ROCHE AG (CH) 2004-10-13 EP 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 (2 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-20070196852-A1 Labeling reagent INMT, RNGTT, DUT CYP4F2 1628/4885CYP4A11 2468/4885CYP4Z1 635/4885
US-20040235022-A1 Quality control method for manufacturing biopolymer arrays CTRL, PCBP1, PARG CYP4F2 2988/4885CYP4A11 3868/4885CYP4Z1 990/4885

“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.