SCHEMBL2011927

SCHEMBL2011927

CCN1CC(C)(C)OC(=O)C1CC(=O)NCc1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
MAPT P10636 4/20 0.50
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
KDM4E B2RXH2 3/20 0.47
LMNA P02545 1/20 0.43
POLB P06746 2/20 0.41
F2 P00734 1/20 0.41
CACNA1G O43497 3/20 0.40
BACE1 P56817 1/20 0.40
TSHR P16473 1/20 0.39
TRPV1 Q8NER1 1/20 0.38
HDAC1 Q13547 1/20 0.38
MCHR1 Q99705 1/20 0.38

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
SCHEMBL2013353 0.94 CACNA1G (0.45) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL2013412 0.88 NPC1 (0.46) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL2016133 0.85 P2RX7 (0.48) ALDH1A1MAPTLMNAPOLBBACE1
SCHEMBL2012284 0.83 EPHX2 (0.46) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL2013632 0.83 MEN1 (0.48) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL2017676 0.82 P2RX7 (0.48) MAPTKMT2AMEN1POLB
SCHEMBL2013716 0.80 ALDH1A1 (0.48) ALDH1A1MAPTKMT2AKDM4ELMNA
SCHEMBL2011699 0.80 LMNA (0.46) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL2013832 0.80 P2RX7 (0.51) MAPTKMT2AKDM4ELMNATSHR
SCHEMBL2013720 0.79 MAPT (0.56) ALDH1A1MAPTKMT2AMEN1KDM4E

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 ALDH1A1 2899/4885MAPT 809/4885KMT2A 4333/4885

“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.