SCHEMBL6154611

SCHEMBL6154611

CC(C)(C)OC(=O)N[C@H]1CC[C@H](Nc2cc(F)c(C#N)cc2Cl)CC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 2/20 0.43
KDM4D Q6B0I6 2/20 0.42
TRPA1 O75762 1/20 0.40
DRD2 P14416 5/20 0.40
CTSK P43235 2/20 0.40
BTK Q06187 2/20 0.39
JAK3 P52333 1/20 0.39
IRAK4 Q9NWZ3 3/20 0.39
TNF P01375 1/20 0.39
KCNA3 P22001 1/20 0.38
KDM1A O60341 1/20 0.38
MAOB P27338 1/20 0.38
DRD3 P35462 2/20 0.38
GPR119 Q8TDV5 1/20 0.38

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
SCHEMBL6154071 1.00 AAK1 (0.43) AAK1KDM4DTRPA1DRD2CTSK
SCHEMBL6154068 1.00 AAK1 (0.43) AAK1KDM4DTRPA1DRD2CTSK
SCHEMBL6154745 0.91 GPR119 (0.44) AAK1KDM4DTRPA1DRD2CTSK
SCHEMBL6154752 0.91 GPR119 (0.44) AAK1KDM4DTRPA1DRD2CTSK
SCHEMBL6154111 0.87 KDM4D (0.42) AAK1KDM4DTRPA1DRD2CTSK
SCHEMBL6154113 0.87 KDM4D (0.42) AAK1KDM4DTRPA1DRD2CTSK
SCHEMBL6153396 0.86 SUV39H2 (0.44) KDM4DDRD2CTSKBTKJAK3
SCHEMBL6154446 0.86 SUV39H2 (0.44) KDM4DDRD2CTSKBTKJAK3
SCHEMBL6153395 0.86 SUV39H2 (0.44) KDM4DDRD2CTSKBTKJAK3
SCHEMBL6153457 0.81 KDM4D (0.49) AAK1KDM4DTRPA1DRD2CTSK

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 AAK1 2415/4885KDM4D 2098/4885TRPA1 691/4885

“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.