SCHEMBL4351862

SCHEMBL4351862

CC1(C)CC2(CC(C)(C)N1)NC(C)(CO)CO2

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.35
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
EPHX1 P07099 1/20 0.31

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
SCHEMBL4346989 0.89 ALDH1A1 (0.32) KDM4EALDH1A1MAPT
SCHEMBL534610 0.77 KDM4E (0.58) KDM4EALDH1A1MAPTPKMPOLB
SCHEMBL4333767 0.76 ALDH1A1 (0.30) ALDH1A1
SCHEMBL11451438 0.71 EPHX1 (0.46) EPHX1
SCHEMBL10171551 0.67 EPHX1 (0.33) KDM4EGAAEPHX1
SCHEMBL9147847 0.67 EPHX1 (0.32) KDM4EALDH1A1EPHX1
SCHEMBL16399256 0.65 EPHX1 (0.34) EPHX1
SCHEMBL9213215 0.64 EPHX1 (0.34) ALDH1A1EPHX1
SCHEMBL243842 0.62
SCHEMBL10938600 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090274947-A1 Imidazolidinone nitroxides as electrode materials for energy storage devices CIBA CORP. 2009-11-05 US 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-20090274947-A1 Imidazolidinone nitroxides as electrode materials for energy storage devices IDH2, NQO1, NOX1 KDM4E 253/4885ALDH1A1 1206/4885MAPT 4084/4885

“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.