SCHEMBL6016908

SCHEMBL6016908

COC1CC2CN(C(=O)OC(C)(C)C)C(C#N)C2CC1OC

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.38
DPP8 Q6V1X1 1/20 0.38
NR1H2 P55055 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
AR P10275 1/20 0.34
CTSK P43235 3/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
GPR119 Q8TDV5 2/20 0.32
CCR2 P41597 2/20 0.32
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 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
SCHEMBL30685043 0.89 DPP4 (0.44) DPP4DPP8NR1H2CHRM2CHRM1
SCHEMBL4307330 0.89 DPP4 (0.44) DPP4DPP8NR1H2CHRM2CHRM1
SCHEMBL6016909 0.85 DPP4 (0.42) DPP4DPP8NR1H2CHRM2CHRM1
SCHEMBL4311573 0.80 DPP4 (0.40) DPP4NR1H2CHRM2CHRM1CHRM3
SCHEMBL4302568 0.80 DPP4 (0.42) DPP4DPP8NR1H2CHRM2CHRM1
SCHEMBL4298430 0.80 MEN1 (0.39) DPP4NR1H2CHRM2CHRM1CHRM3
SCHEMBL4298656 0.77 AR (0.35) DPP4DPP8NR1H2ARCTSK
SCHEMBL20602619 0.77 AR (0.38) DPP4DPP8NR1H2ARCTSK
SCHEMBL25239694 0.72 NR1H2 (0.42) NR1H2CHRM2CHRM1CHRM3MEN1
SCHEMBL11272689 0.71 DPP4 (0.48) DPP4DPP8ALDH1A1MAPT

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
EP-1615886-A1 [C]-FUSED BICYCLIC PROLINE DERIVATIVES AND THEIR USE FOR TREATING ARTHRITIC CONDITIONS Warner-Lambert Company LLC (US) 2006-01-18 EP disclosed
US-20050137215-A1 [C]-fused bicyclic proline derivatives and their use for treating arthritic conditions GUZZO PETER R (US) 2005-06-23 US disclosed
WO-2004092134-A1 [C]-FUSED BICYCLIC PROLINE DERIVATIVES AND THEIR USE FOR TREATING ARTHRITIC CONDITIONS WARNER-LAMBERT COMPANY LLC (US) 2004-10-28 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-20050137215-A1 [C]-fused bicyclic proline derivatives and their use for treating arthritic conditions PPIC, PRAP1, PRRC2C DPP4 288/4885DPP8 352/4885NR1H2 1690/4885

“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.