SCHEMBL22085240

SCHEMBL22085240

C[C@@H]1CN(c2nc(-c3ccc(NC(=O)NCCO)cc3)nn3cccc23)C[C@H](C)O1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTOR P42345 17/20 0.50
PIK3CA P42336 12/20 0.50
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 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
SCHEMBL22087297 0.91 MTOR (0.53) MTORPIK3CA
SCHEMBL24241896 0.91 MTOR (0.53) MTORPIK3CA
SCHEMBL22087315 0.90 MTOR (0.63) MTORPIK3CA
SCHEMBL22085231 0.90 MAPT (0.42) MTORPIK3CAALDH1A1MEN1GAA
SCHEMBL22085251 0.85 PIK3CA (0.53) MTORPIK3CA
SCHEMBL22087028 0.83 MTOR (0.52) MTORPIK3CA
SCHEMBL22085867 0.81 MTOR (0.66) MTORPIK3CA
SCHEMBL22085208 0.81 MTOR (0.63) MTORPIK3CA
SCHEMBL22085232 0.79 MAPT (0.47) MTORPIK3CAALDH1A1
SCHEMBL22085239 0.79 ALDH1A1 (0.41) MTORPIK3CAALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3475285-B1 MECHANISTIC TARGET OF RAPAMYCIN SIGNALING PATHWAY INHIBITORS AND THERAPEUTIC APPLICATIONS THEREOF SUZHOU KINTOR PHARMACEUTICALS INC (CN) 2022-02-09 EP disclosed
US-11242346-B2 Mechanistic target of rapamycin signaling pathway inhibitors and therapeutic applications thereof SUZHOU KINTOR PHARMACEUTICALS, INC. (CN) 2022-02-08 US disclosed
US-20200181147-A1 MECHANISTIC TARGET OF RAPAMYCIN SIGNALING PATHWAY INHIBITORS AND THERAPEUTIC APPLICATIONS THEREOF SUZHOU KINTOR PHARMACEUTICALS, INC. (CN) 2020-06-11 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 (2 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-11242346-B2 Mechanistic target of rapamycin signaling pathway inhibitors and therapeutic applications thereof MTOR, RPTOR, RICTOR MTOR 1/4885PIK3CA 20/4885ALDH1A1 4634/4885
US-20200181147-A1 MECHANISTIC TARGET OF RAPAMYCIN SIGNALING PATHWAY INHIBITORS AND THERAPEUTIC APPLICATIONS THEREOF MTOR, RPTOR, RICTOR MTOR 1/4885PIK3CA 20/4885ALDH1A1 4634/4885

“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.