SCHEMBL21340106

SCHEMBL21340106

Cc1cc(C)c(C(=O)N2CCN(c3ccccn3)[C@@H](C)C2)c(C)c1NC1CCN(c2cnccn2)CC1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTOR P42345 4/20 0.56
RPTOR Q8N122 4/20 0.56
MLST8 Q9BVC4 4/20 0.56
KDM4E B2RXH2 6/20 0.43
GRM1 Q13255 2/20 0.43
TP53 P04637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.40
AVPR1A P37288 2/20 0.39
THRB P10828 1/20 0.38
SLC6A7 Q99884 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
SCHEMBL21340104 0.94 MTOR (0.58) MTORRPTORMLST8KDM4EGRM1
SCHEMBL21360296 0.90 MTOR (0.69) MTORRPTORMLST8KDM4ETP53
SCHEMBL22664833 0.89 MTOR (0.68) MTORRPTORMLST8GRM1SMN1; SMN2
SCHEMBL22664832 0.87 MTOR (0.63) MTORRPTORMLST8KDM4EGRM1
SCHEMBL21360298 0.84 MTOR (0.64) MTORRPTORMLST8KDM4ETP53
SCHEMBL21360295 0.84 MTOR (0.64) MTORRPTORMLST8KDM4ETP53
SCHEMBL22159438 0.84 KDM4E (0.40) MTORRPTORMLST8KDM4EGRM1
SCHEMBL22693124 0.83 MTOR (0.72) MTORRPTORMLST8KDM4ESMN1; SMN2
SCHEMBL22664841 0.83 MTOR (0.68) MTORRPTORMLST8
SCHEMBL20141125 0.80 MTOR (0.80) MTORRPTORMLST8KDM4ETP53

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-10844013-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2020-11-24 US disclosed
US-10414727-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2019-09-17 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 (2 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
US-10414727-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.