SCHEMBL20141287

SCHEMBL20141287

Cc1cc(C)c(C(=O)N2CCN[C@@H](CO[Si](C)(C)C(C)(C)C)C2)cc1NC1CCN(c2ccc(C#N)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTOR P42345 4/20 0.43
RPTOR Q8N122 4/20 0.43
MLST8 Q9BVC4 4/20 0.43
JAK2 O60674 2/20 0.40
JAK1 P23458 2/20 0.40
JAK3 P52333 2/20 0.40
FASN P49327 14/20 0.39

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
SCHEMBL20133840 0.89 MTOR (0.56) MTORRPTORMLST8FASN
SCHEMBL20133554 0.89 MTOR (0.56) MTORRPTORMLST8FASN
SCHEMBL20133541 0.75 MTOR (0.64) MTORRPTORMLST8FASN
SCHEMBL20133555 0.75 MTOR (0.64) MTORRPTORMLST8FASN
SCHEMBL21360330 0.71 MTOR (0.65) MTORRPTORMLST8JAK2JAK1
SCHEMBL20133565 0.70 MTOR (0.81) MTORRPTORMLST8
SCHEMBL20133712 0.70 MTOR (0.62) MTORRPTORMLST8FASN
SCHEMBL20133838 0.70 MTOR (0.62) MTORRPTORMLST8FASN
SCHEMBL20141739 0.69 MTOR (0.47) MTORRPTORMLST8JAK2JAK1
SCHEMBL20140986 0.67 MTOR (0.58) MTORRPTORMLST8FASN

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
EP-3538091-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF Navitor Pharmaceuticals, Inc. (US) 2019-09-18 EP disclosed
WO-2018089499-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed