SCHEMBL12724852

SCHEMBL12724852

COC(=O)c1c(-c2ccccc2C)ccc(-c2ccccc2C)c1C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
LMNA P02545 5/20 0.47
TSHR P16473 4/20 0.47
HTT P42858 2/20 0.47
GAA P10253 2/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
HPGD P15428 2/20 0.46
ALDH1A1 P00352 1/20 0.46
PRKCZ Q05513 1/20 0.46
NR4A2 P43354 2/20 0.46
MAPK1 P28482 1/20 0.46
FGFR1 P11362 1/20 0.45
FGFR2 P21802 1/20 0.45
FGFR4 P22455 1/20 0.45

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
SCHEMBL12703512 0.91 CA12 (0.46) CA12CA1CA2CA7CA9
SCHEMBL28138154 0.85 TSHR (0.50) CA12CA1CA2CA7CA9
SCHEMBL14052524 0.85 NCEH1 (0.54) CA12CA1CA2CA7CA9
SCHEMBL2267132 0.85 SLC6A3 (0.51) LMNATSHRHTTMEN1KMT2A
SCHEMBL70172 0.83 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL28295595 0.83 MYC (0.56) CA12CA1CA2CA7CA9
SCHEMBL9549 0.82 SLC6A3 (0.57) CA1CA2CA9LMNATSHR
SCHEMBL410258 0.82 PDK2 (0.51) CA12CA1CA2CA7CA9
Bicarbonate SCHEMBL27492792 0.79 SLC6A3 (0.54) LMNATSHRHTTMEN1KMT2A
SCHEMBL408614 0.79 XDH (0.59) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2276723-B1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-01-27 EP disclosed
US-8766001-B2 Compounds for electronic devices MERCK PATENT GMBH (DE) 2014-07-01 US disclosed
US-20110092701-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-04-21 US disclosed
WO-2009141026-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH, (DE) 2009-11-26 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-20110092701-A1 COMPOUNDS FOR ELECTRONIC DEVICES SLCO4C1, SLCO2A1, TOE1 CA12 3963/4885CA1 4202/4885CA2 4216/4885

“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.