SCHEMBL5089073

SCHEMBL5089073

CC(C)(C)OC(=O)N1CCC(Oc2ccc(CN)cc2)C1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.54
USP30 Q70CQ3 1/20 0.53
CHEK2 O96017 2/20 0.48
PIK3CD O00329 2/20 0.47
ALDH1A1 P00352 1/20 0.45
S1PR3 Q99500 1/20 0.44
PRMT5 O14744 1/20 0.44
WDR77 Q9BQA1 1/20 0.44
KDM1A O60341 1/20 0.44
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43

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
SCHEMBL3342725 0.93 GPR119 (0.61) GPR119USP30CHEK2ALDH1A1KDM1A
SCHEMBL7558767 0.91 GPR119 (0.52) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL7558762 0.91 GPR119 (0.52) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL15297678 0.88 GPR119 (0.56) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL699609 0.88 GPR119 (0.58) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL15376614 0.88 GPR119 (0.58) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL699608 0.88 GPR119 (0.58) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL23355604 0.87 GPR119 (0.53) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL6925094 0.87 GPR119 (0.53) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL28523541 0.87 GPR119 (0.53) GPR119USP30CHEK2PIK3CDALDH1A1

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-7425641-B2 Carboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2008-09-16 US disclosed
US-20050065346-A1 Carboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2005-03-24 US disclosed
EP-1206446-B1 CARBOXYLIC ACID AMIDES, THEIR PRODUCTION AND THEIR USE AS DRUGS BOEHRINGER INGELHEIM PHARMA (DE) 2004-05-26 EP 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-20050065346-A1 Carboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions F12, F11, F2 GPR119 1071/4885USP30 4402/4885CHEK2 3103/4885

“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.