SCHEMBL22693166

SCHEMBL22693166

Cc1cc(C)c(C(=O)N2CCN(c3ccccc3)C(C(C)(C)O)C2)cc1NC1CCN(c2ccccc2C#N)CC1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTOR P42345 9/20 0.61
RPTOR Q8N122 9/20 0.61
MLST8 Q9BVC4 9/20 0.61
HCRTR1 O43613 2/20 0.35
HCRTR2 O43614 2/20 0.35
DPP4 P27487 1/20 0.34
GRM1 Q13255 1/20 0.34
NAMPT P43490 1/20 0.34
GRM5 P41594 1/20 0.34
DRD2 P14416 1/20 0.34
DRD4 P21917 1/20 0.34
DRD3 P35462 1/20 0.34
CHRM4 P08173 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
FASN P49327 1/20 0.33

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
SCHEMBL21360299 1.00 MTOR (0.61) MTORRPTORMLST8HCRTR1HCRTR2
SCHEMBL21360291 1.00 MTOR (0.61) MTORRPTORMLST8HCRTR1HCRTR2
SCHEMBL20133851 0.89 MTOR (0.64) MTORRPTORMLST8HCRTR1HCRTR2
SCHEMBL20149799 0.89 MTOR (0.64) MTORRPTORMLST8HCRTR1HCRTR2
SCHEMBL20133695 0.89 MTOR (0.64) MTORRPTORMLST8HCRTR1HCRTR2
SCHEMBL21340100 0.89 MTOR (0.64) MTORRPTORMLST8HCRTR1HCRTR2
SCHEMBL21360357 0.87 MTOR (0.62) MTORRPTORMLST8HCRTR1HCRTR2
SCHEMBL21360348 0.87 MTOR (0.62) MTORRPTORMLST8HCRTR1HCRTR2
SCHEMBL21360387 0.87 MTOR (0.64) MTORRPTORMLST8HCRTR1HCRTR2
SCHEMBL21360358 0.87 MTOR (0.64) MTORRPTORMLST8HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10844013-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2020-11-24 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-10844013-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof MTOR, RICTOR, RPTOR MTOR 1/4885RPTOR 3/4885MLST8 7/4885

“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.