SCHEMBL3534085

SCHEMBL3534085

COC(=O)[C@H](C)N1CC[C@@]2(CCCN2C(=O)OC(C)(C)C)C1=O

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.57
GRIN2C Q14957 1/20 0.57
CDK4 P11802 1/20 0.35
MMP1 P03956 2/20 0.33
MMP2 P08253 2/20 0.33
MMP9 P14780 2/20 0.33
JAK3 P52333 2/20 0.33
PHGDH O43175 1/20 0.32
TSHR P16473 2/20 0.31
ALOX15 P16050 1/20 0.31
HTT P42858 1/20 0.30
ATM Q13315 1/20 0.30
EPHX2 P34913 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
SCHEMBL3535136 1.00 GRIN2B (0.57) GRIN2BGRIN2CCDK4MMP1MMP2
SCHEMBL3533735 1.00 GRIN2B (0.57) GRIN2BGRIN2CCDK4MMP1MMP2
SCHEMBL3535138 1.00 GRIN2B (0.57) GRIN2BGRIN2CCDK4MMP1MMP2
SCHEMBL23835781 0.87 GRIN2B (0.63) GRIN2BGRIN2CCDK4JAK3TSHR
SCHEMBL24740823 0.83 GRIN2B (0.58) GRIN2BGRIN2CCDK4JAK3TSHR
SCHEMBL30008265 0.82 GRIN2B (0.48) GRIN2BGRIN2CCDK4JAK3
SCHEMBL30008807 0.82 GRIN2B (0.48) GRIN2BGRIN2CCDK4JAK3
SCHEMBL19229634 0.80 GRIN2B (0.70) GRIN2BGRIN2CCDK4JAK3
SCHEMBL24339067 0.80 GRIN2B (0.84) GRIN2BGRIN2CCDK4JAK3TSHR
SCHEMBL30310450 0.79 GRIN2B (0.46) GRIN2BGRIN2CCDK4JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7655686-B2 Certain substituted spirocyclic lactams and use thereof as pharmaceuticals NOVARTIS AG (CH) 2010-02-02 US disclosed
EP-1670803-B1 CERTAIN SUBSTITUTED SPIROCYCLIC LACTAMS AND USE THEREOF AS PHARMACEUTICALS NOVARTIS AG (CH) 2008-03-12 EP disclosed
US-20070265328-A1 Certain substituted spirocyclic lactams and use thereof as pharmaceuticals NOVARTIS AG (CH) 2007-11-15 US disclosed
US-20070015781-A1 Certain substituted spirocyclic lactams and use thereof as pharmaceuticals AUBERSON YVES 2007-01-18 US disclosed
EP-1670803-A1 CERTAIN SUBSTITUTED SPIROCYCLIC LACTAMS AND USE THEREOF AS PHARMACEUTICALS Novartis AG (CH) 2006-06-21 EP disclosed
WO-2005035535-A1 CERTAIN SUBSTITUTED SPIROCYCLIC LACTAMS AND USE THEREOF AS PHARMACEUTICALS NOVARTIS AG (CH) 2005-04-21 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 (2 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-20070265328-A1 Certain substituted spirocyclic lactams and use thereof as pharmaceuticals STS, RPS6KA5, RPIA GRIN2B 2525/4885GRIN2C 1610/4885CDK4 268/4885
US-20070015781-A1 Certain substituted spirocyclic lactams and use thereof as pharmaceuticals STS, RPS6KA5, RPIA GRIN2B 2525/4885GRIN2C 1610/4885CDK4 268/4885

“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.