SCHEMBL22693277

SCHEMBL22693277

Cc1cc(C)c(C(=O)N2CCN(c3ncccc3SN)CC2)cc1NC1CCN(c2ccccc2C#N)CC1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MTOR P42345 9/20 0.65
RPTOR Q8N122 9/20 0.65
MLST8 Q9BVC4 9/20 0.65
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
RECQL P46063 1/20 0.41
FASN P49327 2/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
JAK3 P52333 1/20 0.39
KCNH2 Q12809 1/20 0.39
CFTR P13569 1/20 0.38
HDAC2 Q92769 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MLNR O43193 1/20 0.38
SYK P43405 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
SCHEMBL21360382 0.89 MTOR (0.67) MTORRPTORMLST8KDM4EALDH1A1
SCHEMBL21360324 0.89 MTOR (0.76) MTORRPTORMLST8KDM4EALDH1A1
SCHEMBL20149685 0.88 MTOR (0.79) MTORRPTORMLST8KDM4EALDH1A1
SCHEMBL22187978 0.88 MTOR (0.69) MTORRPTORMLST8KDM4EALDH1A1
SCHEMBL20150210 0.87 MTOR (0.64) MTORRPTORMLST8KDM4EALDH1A1
SCHEMBL20150036 0.87 MTOR (0.73) MTORRPTORMLST8KDM4EALDH1A1
SCHEMBL20149693 0.87 MTOR (0.63) MTORRPTORMLST8ALDH1A1TDP1
SCHEMBL22693210 0.87 MTOR (0.64) MTORRPTORMLST8KDM4EALDH1A1
SCHEMBL20150152 0.86 MTOR (0.67) MTORRPTORMLST8KDM4EALDH1A1
SCHEMBL20149839 0.86 MTOR (0.65) MTORRPTORMLST8KDM4EALDH1A1

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.