SCHEMBL14215417

SCHEMBL14215417

CC(C)(C)C(=O)NC1CCN(S(C)(=O)=O)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.57
GAA P10253 1/20 0.56
EPHX2 P34913 4/20 0.51
EPHX1 P07099 1/20 0.51
LMNA P02545 2/20 0.50
TP53 P04637 1/20 0.49
SMYD3 Q9H7B4 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
POLB P06746 1/20 0.44
NPY5R Q15761 2/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL2746762 0.87 EPHX2 (0.49) ALDH1A1GAAEPHX2EPHX1LMNA
SCHEMBL5537204 0.84 EPHX2 (0.47) ALDH1A1GAAEPHX2EPHX1LMNA
SCHEMBL19176862 0.84 ALDH1A1 (0.48) ALDH1A1GAAEPHX2EPHX1LMNA
SCHEMBL19169605 0.83 TP53 (0.46) ALDH1A1GAAEPHX2EPHX1LMNA
SCHEMBL21638019 0.82 ALDH1A1 (0.44) ALDH1A1GAAEPHX2EPHX1LMNA
SCHEMBL5537247 0.82 EPHX2 (0.57) ALDH1A1GAAEPHX2LMNANPSR1
SCHEMBL4919816 0.82 EPHX2 (0.65) ALDH1A1EPHX2EPHX1LMNATP53
SCHEMBL10266067 0.81 ALDH1A1 (0.56) ALDH1A1GAALMNAPOLBCA12
SCHEMBL2937346 0.80 TP53 (0.58) ALDH1A1EPHX2EPHX1LMNATP53
SCHEMBL14383590 0.80 EPHX2 (0.55) ALDH1A1EPHX2EPHX1LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9993554-B2 Use of P13K Inhibitors for the Treatment of Obesity, Steatosis and ageing CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS (CNIO) (ES) 2018-06-12 US disclosed
US-8367666-B2 3-carbamoyl-2-pyridone derivatives SHIONOGI & CO., LTD. (JP) 2013-02-05 US disclosed
US-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative SHIONOGI & CO. LTD. (JP) 2008-05-01 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-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative CNR1, CNR2, HRH4 ALDH1A1 4132/4885GAA 4580/4885EPHX2 1521/4885

“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.