SCHEMBL10240131

SCHEMBL10240131

CO[C@H]1CC[C@H](CN2CC(=O)Nc3ncc(-c4cnc(C(N)=O)cc4C)nc32)CC1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTOR P42345 17/20 0.60
RPTOR Q8N122 10/20 0.60
MLST8 Q9BVC4 10/20 0.60
PIK3CA P42336 9/20 0.60
RICTOR Q6R327 2/20 0.46
MAPKAP1 Q9BPZ7 2/20 0.46
CSF1R P07333 1/20 0.46
PADI4 Q9UM07 2/20 0.36
OPRM1 P35372 1/20 0.34

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
SCHEMBL15176846 0.85 MTOR (0.59) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL154849 0.85 MTOR (0.59) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL154850 0.85 MTOR (0.59) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL138616 0.83 MTOR (0.56) MTORRPTORMLST8PIK3CARICTOR
SCHEMBL151120 0.82 MTOR (0.60) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL151121 0.82 MTOR (0.60) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL153565 0.82 MTOR (0.60) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL151476 0.79 MTOR (0.54) MTORRPTORMLST8PIK3CARICTOR
SCHEMBL154351 0.79 MTOR (0.54) MTORRPTORMLST8PIK3CARICTOR
SCHEMBL29522054 0.79 MTOR (0.54) MTORRPTORMLST8PIK3CARICTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8110578-B2 Pyrazino[2,3-b]pyrazine mTOR kinase inhibitors for oncology indications and diseases associated with the mTOR/PI3K/Akt pathway SIGNAL PHARMACEUTICALS, LLC (US) 2012-02-07 US disclosed
US-8110578-B2 Pyrazino[2,3-b]pyrazine mTOR kinase inhibitors for oncology indications and diseases associated with the mTOR/PI3K/Akt pathway SIGNAL PHARMACEUTICALS, LLC (US) 2012-02-07 US disclosed
US-20100216781-A1 mTOR KINASE INHIBITORS FOR ONCOLOGY INDICATIONS AND DISEASES ASSOCIATED WITH THE mTOR/PI3K/AKT PATHWAY SIGNAL PHARMACEUTICALS, LLC 2010-08-26 US disclosed
US-20100216781-A1 mTOR KINASE INHIBITORS FOR ONCOLOGY INDICATIONS AND DISEASES ASSOCIATED WITH THE mTOR/PI3K/AKT PATHWAY SIGNAL PHARMACEUTICALS, LLC 2010-08-26 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-20100216781-A1 mTOR KINASE INHIBITORS FOR ONCOLOGY INDICATIONS AND DISEASES ASSOCIATED WITH THE mTOR/PI3K/AKT PATHWAY MTOR, RICTOR, RPTOR MTOR 1/4885RPTOR 3/4885MLST8 33/4885

“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.