SCHEMBL6154205

SCHEMBL6154205

CC(C)(C)OC(=O)N1CCC(Nc2ccc(C#N)cc2Cl)C1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.54
IRAK4 Q9NWZ3 2/20 0.47
ALDH1A1 P00352 2/20 0.46
NPC1 O15118 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
BRD4 O60885 1/20 0.46
PIK3CD O00329 1/20 0.45
CNR1 P21554 3/20 0.44
NSD2 O96028 1/20 0.43
TNF P01375 2/20 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
SCHEMBL6156720 0.93 GPR119 (0.49) GPR119IRAK4ALDH1A1MAPTBRD4
SCHEMBL7178327 0.88 GPR119 (0.54) GPR119IRAK4ALDH1A1NPC1MAPT
SCHEMBL7178322 0.88 GPR119 (0.54) GPR119IRAK4ALDH1A1NPC1MAPT
SCHEMBL7189717 0.88 GPR119 (0.54) GPR119IRAK4ALDH1A1NPC1MAPT
SCHEMBL7183947 0.84 GPR119 (0.51) GPR119IRAK4ALDH1A1NPC1MAPT
SCHEMBL7182933 0.84 GPR119 (0.51) GPR119IRAK4ALDH1A1NPC1MAPT
SCHEMBL7182925 0.84 GPR119 (0.51) GPR119IRAK4ALDH1A1NPC1MAPT
SCHEMBL6154449 0.83 ALDH1A1 (0.61) GPR119IRAK4ALDH1A1NPC1MAPT
SCHEMBL13238913 0.83 ALDH1A1 (0.61) GPR119IRAK4ALDH1A1NPC1MAPT
SCHEMBL331605 0.81 ALDH1A1 (0.51) GPR119IRAK4ALDH1A1NPC1MAPT

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-20050182040-A1 Benzamide derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2005-08-18 US disclosed
EP-1500643-A1 BENZAMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-01-26 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-20050182040-A1 Benzamide derivatives ROCK1, ROCK2, NHERF1 GPR119 279/4885IRAK4 3240/4885ALDH1A1 2454/4885

“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.