SCHEMBL2012480

SCHEMBL2012480

CC(C)(C)OC(=O)CC1C(=O)OC(C)(C)CN1Cc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 1/20 0.39
PLA2G5 P39877 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
GAA P10253 1/20 0.35
ALDH1A1 P00352 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRL1 P41146 1/20 0.35
GRM6 O15303 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
USP2 O75604 1/20 0.35
PDK1 Q15118 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
SCHEMBL2012481 0.85 GAA (0.40) MAPTTHRBGAAALDH1A1GRM6
SCHEMBL12805931 0.82 L3MBTL1 (0.37) PLA2G10PLA2G5L3MBTL1KMT2AMAPT
SCHEMBL12805521 0.77 RORC (0.35) PLA2G10PLA2G5L3MBTL1MAPTALDH1A1
SCHEMBL2015469 0.74 RAB9A (0.47) L3MBTL1MAPTTHRBALDH1A1
SCHEMBL2048751 0.70 MAPT (0.30) MAPT
SCHEMBL19213032 0.70 TSHR (0.38) PLA2G10PLA2G5L3MBTL1KMT2AALDH1A1
SCHEMBL15984354 0.70 USP2 (0.69) USP2PDK1PDK2PDK3PDK4
SCHEMBL2015667 0.69 SIGMAR1 (0.54) L3MBTL1
SCHEMBL30645042 0.68 USP2 (0.44) PLA2G10PLA2G5KMT2AUSP2KLK7
SCHEMBL2014597 0.68 KDM4E (0.40) KMT2AMAPTALDH1A1

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-2513069-B1 ANTIFUNGAL COMPOUNDS UNIV LEUVEN KATH (BE) 2014-10-15 EP disclosed
EP-2513069-A1 ANTIFUNGAL COMPOUNDS Katholieke Universiteit Leuven (BE) 2012-10-24 EP disclosed
US-20120252801-A1 ANTIFUNGAL COMPOUNDS KATHOLIEKE UNIVERSITEIT LEUVEN, K.U.LEUVEN R&D (BE) 2012-10-04 US disclosed
WO-2011072345-A1 ANTIFUNGAL COMPOUNDS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2011-06-23 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-20120252801-A1 ANTIFUNGAL COMPOUNDS ERG28, DPM1, CYP51A1 PLA2G10 2889/4885PLA2G5 3521/4885L3MBTL1 4233/4885

“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.