SCHEMBL12239153

SCHEMBL12239153

CC(C)(C)OC(=O)N1CCC(Oc2ccc(CN3CCN(S(C)(=O)=O)CC3)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.60
ADRB2 P07550 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46

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
SCHEMBL13660321 0.87 HRH3 (0.60) GPR119ADRB2MEN1KMT2AALDH1A1
SCHEMBL1005823 0.86 ALDH1A1 (0.53) ADRB2MEN1KMT2AALDH1A1KDM4E
SCHEMBL1004178 0.86 GPR119 (0.46) GPR119ADRB2MEN1KMT2AALDH1A1
SCHEMBL5205491 0.84 HRH3 (0.60) GPR119ADRB2MEN1KMT2AHRH3
SCHEMBL3587239 0.84 GPR119 (0.58) GPR119ADRB2MEN1KMT2AHRH3
SCHEMBL3583221 0.82 ADRB2 (0.58) ADRB2MEN1KMT2AALDH1A1KDM4E
SCHEMBL22533161 0.81 GPR119 (0.61) GPR119ALDH1A1HRH3
SCHEMBL3347332 0.81 GPR119 (0.65) GPR119HRH3
SCHEMBL23373231 0.80 GPR119 (0.63) GPR119ADRB2MEN1KMT2AALDH1A1
SCHEMBL12239155 0.80 HRH3 (0.55) ADRB2MEN1KMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-10-27 US disclosed
US-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-10-27 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-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY GPR119, GPR55, NR1H2 GPR119 1/4885ADRB2 131/4885MEN1 3687/4885

“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.