SCHEMBL2013720

SCHEMBL2013720

CCN1CC(C)(C)OC(=O)C1CC(=O)NCc1ccccc1C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.56
P2RX7 Q99572 7/20 0.49
ALDH1A1 P00352 4/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 6/20 0.46
KDM4E B2RXH2 3/20 0.44
MEN1 O00255 4/20 0.43
TAOK1 Q7L7X3 1/20 0.41
TAOK3 Q9H2K8 1/20 0.41

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
SCHEMBL2013234 0.86 ALDH1A1 (0.47) MAPTP2RX7ALDH1A1KMT2AKDM4E
SCHEMBL2011251 0.85 NPC1 (0.47) MAPTP2RX7ALDH1A1KMT2AMEN1
SCHEMBL2011699 0.83 LMNA (0.46) MAPTALDH1A1GAAKMT2AKDM4E
SCHEMBL2013353 0.83 CACNA1G (0.45) MAPTALDH1A1GAAKMT2AKDM4E
SCHEMBL2013832 0.81 P2RX7 (0.51) MAPTP2RX7KMT2AKDM4E
SCHEMBL2011927 0.79 ALDH1A1 (0.50) MAPTALDH1A1KMT2AKDM4EMEN1
SCHEMBL2017246 0.78 MAPT (0.43) MAPTKMT2A
SCHEMBL2013918 0.76 MAPT (0.40) MAPTALDH1A1KMT2A
SCHEMBL2013221 0.74 MAPT (0.52) MAPTALDH1A1GAAKMT2AKDM4E
SCHEMBL2010964 0.74 MAPT (0.38) MAPTALDH1A1KMT2AKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2513069-B1 ANTIFUNGAL COMPOUNDS UNIV LEUVEN KATH (BE) 2014-10-15 EP claimed
EP-2513069-A1 ANTIFUNGAL COMPOUNDS Katholieke Universiteit Leuven (BE) 2012-10-24 EP claimed
US-20120252801-A1 ANTIFUNGAL COMPOUNDS KATHOLIEKE UNIVERSITEIT LEUVEN, K.U.LEUVEN R&D (BE) 2012-10-04 US claimed
WO-2011072345-A1 ANTIFUNGAL COMPOUNDS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2011-06-23 WO claimed
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
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 MAPT 809/4885P2RX7 2280/4885ALDH1A1 2899/4885

“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.