SCHEMBL6154752

SCHEMBL6154752

CC(C)(C)OC(=O)N[C@H]1CC[C@H](Nc2cc(F)c(C#N)cc2F)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.44
KDM4D Q6B0I6 2/20 0.44
AAK1 Q2M2I8 2/20 0.43
CTSK P43235 2/20 0.43
TRPA1 O75762 1/20 0.43
DRD2 P14416 1/20 0.42
KDM1A O60341 1/20 0.41
MAOB P27338 1/20 0.41
KCNA3 P22001 1/20 0.41
IRAK4 Q9NWZ3 3/20 0.41
TNF P01375 1/20 0.41
USP30 Q70CQ3 1/20 0.39
ROCK2 O75116 1/20 0.38
RET P07949 1/20 0.38
BTK Q06187 1/20 0.37

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
SCHEMBL6154745 1.00 GPR119 (0.44) GPR119KDM4DAAK1CTSKTRPA1
SCHEMBL6154111 0.91 KDM4D (0.42) GPR119KDM4DAAK1CTSKTRPA1
SCHEMBL6154113 0.91 KDM4D (0.42) GPR119KDM4DAAK1CTSKTRPA1
SCHEMBL6154611 0.91 AAK1 (0.43) GPR119KDM4DAAK1CTSKTRPA1
SCHEMBL6154071 0.91 AAK1 (0.43) GPR119KDM4DAAK1CTSKTRPA1
SCHEMBL6154068 0.91 AAK1 (0.43) GPR119KDM4DAAK1CTSKTRPA1
SCHEMBL6153458 0.84 KDM4D (0.49) GPR119KDM4DAAK1CTSKTRPA1
SCHEMBL6153457 0.84 KDM4D (0.49) GPR119KDM4DAAK1CTSKTRPA1
SCHEMBL6155283 0.84 KDM4D (0.49) GPR119KDM4DAAK1CTSKTRPA1
SCHEMBL6154623 0.81 ROCK2 (0.44) IRAK4USP30ROCK2

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 279/4885KDM4D 2098/4885AAK1 2415/4885

“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.