SCHEMBL20133659

SCHEMBL20133659

Cc1cc(C)c(C(=O)N2CCN(c3ccccc3S(C)(=N)=O)CC2)nc1NC1CCN(c2ccccc2C#N)CC1

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MTOR P42345 9/20 0.74
RPTOR Q8N122 9/20 0.74
MLST8 Q9BVC4 9/20 0.74
GPR6 P46095 5/20 0.40
PHGDH O43175 1/20 0.40
TACR3 P29371 1/20 0.38
NAMPT P43490 1/20 0.38
GRM5 P41594 1/20 0.38
DRD2 P14416 1/20 0.37
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 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
SCHEMBL20133676 1.00 MTOR (0.74) MTORRPTORMLST8GPR6PHGDH
SCHEMBL22187975 0.94 MTOR (0.75) MTORRPTORMLST8GPR6PHGDH
SCHEMBL22693199 0.92 MTOR (0.64) MTORRPTORMLST8GPR6PHGDH
SCHEMBL20133657 0.92 MTOR (0.84) MTORRPTORMLST8GPR6PHGDH
SCHEMBL22188079 0.91 MTOR (0.73) MTORRPTORMLST8GPR6PHGDH
SCHEMBL20133710 0.88 MTOR (0.67) MTORRPTORMLST8GPR6PHGDH
SCHEMBL20133774 0.88 MTOR (0.67) MTORRPTORMLST8GPR6PHGDH
SCHEMBL20133547 0.86 MTOR (0.75) MTORRPTORMLST8GPR6PHGDH
SCHEMBL20133671 0.85 MTOR (1.00) MTORRPTORMLST8GPR6
SCHEMBL20149898 0.85 MTOR (0.69) MTORRPTORMLST8GPR6PHGDH

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 5 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-20200207716-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2020-07-02 US disclosed
US-10414727-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2019-09-17 US disclosed
WO-2018089499-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed
US-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2018-05-10 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 (4 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
US-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR MTOR 1/4885RPTOR 3/4885MLST8 7/4885
US-20200207716-A1 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.