SCHEMBL2298654

SCHEMBL2298654

COC(=O)C1(CC=C(C)C)CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
JAK3 P52333 2/20 0.34
CTSK P43235 1/20 0.33
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
EPHX1 P07099 1/20 0.30
PKM P14618 1/20 0.30
USP2 O75604 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL443093 0.89 GRIN2B (0.36) GRIN2BGRIN2CJAK3CTSKPKM
SCHEMBL12386413 0.87 GRIN2B (0.36) GRIN2BGRIN2CJAK3CTSKEPHX1
SCHEMBL2302513 0.87 GRIN2B (0.36) GRIN2BGRIN2CJAK3CTSKEPHX1
SCHEMBL14282561 0.86 GRIN2B (0.35) GRIN2BGRIN2CJAK3CTSKEPHX1
SCHEMBL1949227 0.86 GRIN2B (0.35) GRIN2BGRIN2CJAK3CTSKEPHX1
SCHEMBL21238733 0.83 GRIN2B (0.36) GRIN2BGRIN2CJAK3CTSK
SCHEMBL21238731 0.83 GRIN2B (0.34) GRIN2BGRIN2CJAK3CTSK
SCHEMBL15936852 0.83 GRIN2B (0.38) GRIN2BGRIN2CJAK3CTSKCHRM2
SCHEMBL25297924 0.82 GRIN2B (0.37) GRIN2BGRIN2CJAK3CTSKCHRM2
SCHEMBL20437959 0.81 GRIN2B (0.37) GRIN2BGRIN2CJAK3CTSKEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7998959-B2 Modulators of 11-β hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION (US) 2011-08-16 US disclosed
US-7998959-B2 Modulators of 11-β hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION (US) 2011-08-16 US disclosed
US-7998959-B2 Modulators of 11-β hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION (US) 2011-08-16 US disclosed
US-20070197506-A1 Modulators of 11-beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION 2007-08-23 US disclosed
US-20070197506-A1 Modulators of 11-beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION 2007-08-23 US disclosed
US-20070197506-A1 Modulators of 11-beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same INCYTE CORPORATION 2007-08-23 US disclosed
WO-2007084314-A2 MODULATORS OF 11-ß HYDROXYL STEROID DEHYDROGENASE TYPE 1, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2007-07-26 WO disclosed
WO-2007084314-A2 MODULATORS OF 11-ß HYDROXYL STEROID DEHYDROGENASE TYPE 1, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2007-07-26 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-20070197506-A1 Modulators of 11-beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same HSD11B1, HSD17B1, HSD3B1 GRIN2B 2088/4885GRIN2C 1792/4885JAK3 4852/4885

“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.