SCHEMBL22693201

SCHEMBL22693201

Cc1cc(F)c(C(=O)N2CCN(c3ccccc3S(N)(=O)=O)CC2)cc1NN1CCN(c2ccccc2C#N)CC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTOR P42345 6/20 0.53
RPTOR Q8N122 6/20 0.53
MLST8 Q9BVC4 6/20 0.53
DPP4 P27487 1/20 0.42
LMNA P02545 2/20 0.40
PARP1 P09874 1/20 0.40
TSHR P16473 2/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
SLC6A9 P48067 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DRD4 P21917 1/20 0.38
PANK3 Q9H999 1/20 0.38
MEN1 O00255 1/20 0.38
PKM P14618 1/20 0.38
KMT2A Q03164 1/20 0.38
NAMPT P43490 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
SCHEMBL20133718 0.89 MTOR (0.68) MTORRPTORMLST8DPP4LMNA
SCHEMBL22693248 0.85 MTOR (0.50) MTORRPTORMLST8LMNATSHR
SCHEMBL20133670 0.84 MTOR (0.69) MTORRPTORMLST8DPP4LMNA
SCHEMBL21360359 0.81 MTOR (0.71) MTORRPTORMLST8DPP4DRD4
SCHEMBL20133543 0.81 MTOR (0.62) MTORRPTORMLST8DPP4DRD4
SCHEMBL20133661 0.79 MTOR (0.56) MTORRPTORMLST8DPP4LMNA
SCHEMBL20141041 0.79 MTOR (0.62) MTORRPTORMLST8LMNAMAPT
SCHEMBL20133549 0.79 MTOR (0.64) MTORRPTORMLST8LMNAMAPT
SCHEMBL20133552 0.79 MTOR (0.66) MTORRPTORMLST8DPP4DRD4
SCHEMBL20140890 0.79 MTOR (0.57) MTORRPTORMLST8LMNADRD4

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.