SCHEMBL22693274

SCHEMBL22693274

Cc1cc(C)c(C(=O)N2CCN(c3ccccc3C#N)CC2)nc1NC1CCN(c2cccc(Cl)c2)CC1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MTOR P42345 6/20 0.67
RPTOR Q8N122 6/20 0.67
MLST8 Q9BVC4 6/20 0.67
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.45
ALDH1A1 P00352 2/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TACR3 P29371 1/20 0.43
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
USP2 O75604 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL22693272 0.92 MTOR (0.67) MTORRPTORMLST8MAPT
SCHEMBL20149898 0.85 MTOR (0.69) MTORRPTORMLST8TACR3DRD2
SCHEMBL20133691 0.84 MTOR (0.69) MTORRPTORMLST8LMNAALDH1A1
SCHEMBL20150021 0.84 MTOR (0.70) MTORRPTORMLST8TACR3DRD4
SCHEMBL22187975 0.84 MTOR (0.75) MTORRPTORMLST8TACR3DRD2
SCHEMBL20133676 0.83 MTOR (0.74) MTORRPTORMLST8TACR3DRD2
SCHEMBL20133657 0.83 MTOR (0.84) MTORRPTORMLST8TACR3DRD2
SCHEMBL20133659 0.83 MTOR (0.74) MTORRPTORMLST8TACR3DRD2
SCHEMBL20133662 0.83 MTOR (0.65) MTORRPTORMLST8ALDH1A1DRD2
SCHEMBL20133660 0.82 MTOR (0.72) MTORRPTORMLST8ALDH1A1SMN1; SMN2

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.