SCHEMBL5086233

SCHEMBL5086233

CC(C)(C)OC(=O)N1CCC(NCc2ccc(-c3ccc(C(N)=O)cc3)nc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.52
HDAC1 Q13547 1/20 0.45
HDAC4 P56524 1/20 0.45
USP30 Q70CQ3 1/20 0.45
CHEK2 O96017 2/20 0.44
SCN9A Q15858 1/20 0.44

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
SCHEMBL5083436 0.90 USP30 (0.45) GPR119HDAC1USP30CHEK2SCN9A
SCHEMBL4097506 0.87 GPR119 (0.57) GPR119HDAC1USP30
SCHEMBL3987206 0.87 GPR119 (0.53) GPR119HDAC1HDAC4
SCHEMBL3987089 0.86 GPR119 (0.59) GPR119
SCHEMBL3984151 0.85 NPC1 (0.40) GPR119USP30
SCHEMBL3984090 0.85 CXCR4 (0.42) USP30
SCHEMBL16466490 0.81 USP30 (0.48) GPR119USP30
SCHEMBL3984822 0.80 ALDH1A1 (0.48) GPR119USP30
SCHEMBL3984528 0.80 GPR119 (0.49) GPR119HDAC1USP30
SCHEMBL3983980 0.80 USP30 (0.46) GPR119HDAC1USP30

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-20080103123-A1 New compounds BIOVITRUM (SE) 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-20080103123-A1 New compounds GPR119, GPR139, GPR180 GPR119 1/4885HDAC1 2847/4885HDAC4 3031/4885

“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.