SCHEMBL22693121

SCHEMBL22693121

Cc1cc(C)c(C(=O)N2CCN(c3ccccc3C)[C@@H](CO)C2)cc1NC1CCN(c2cc#ccc2C#N)CC1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MTOR P42345 9/20 0.69
RPTOR Q8N122 9/20 0.69
MLST8 Q9BVC4 9/20 0.69
KDM1A O60341 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MC2R Q01718 1/20 0.32
FASN P49327 4/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
LMNA P02545 1/20 0.32
DPP4 P27487 1/20 0.32

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
SCHEMBL20133690 0.92 MTOR (0.77) MTORRPTORMLST8KDM1AALDH1A1
SCHEMBL20150230 0.92 MTOR (0.77) MTORRPTORMLST8KDM1AALDH1A1
SCHEMBL20133553 0.92 MTOR (0.77) MTORRPTORMLST8KDM1AALDH1A1
SCHEMBL22693152 0.92 MTOR (0.66) MTORRPTORMLST8ALDH1A1SMN1; SMN2
SCHEMBL21360321 0.89 MTOR (0.80) MTORRPTORMLST8ALDH1A1MC2R
SCHEMBL21360288 0.89 MTOR (0.80) MTORRPTORMLST8ALDH1A1MC2R
SCHEMBL22693127 0.87 MTOR (0.86) MTORRPTORMLST8ALDH1A1HCRTR1
SCHEMBL20141344 0.86 MTOR (0.82) MTORRPTORMLST8ALDH1A1SMN1; SMN2
SCHEMBL21360360 0.86 MTOR (0.82) MTORRPTORMLST8ALDH1A1SMN1; SMN2
SCHEMBL22693123 0.86 MTOR (0.58) MTORRPTORMLST8FASN

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.