SCHEMBL2369907

SCHEMBL2369907

CC1COCCN1c1cc(-c2cncc(F)c2)nc(-c2ccc(NC(=O)NCCO)cc2F)n1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTOR P42345 10/20 0.56
PIK3CA P42336 9/20 0.56
PIK3CD O00329 5/20 0.48
RAF1 P04049 4/20 0.44
BRAF P15056 4/20 0.44
PIK3CB P42338 1/20 0.44
PIK3CG P48736 1/20 0.44
PIK3R1 P27986 2/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL2369900 1.00 MTOR (0.56) MTORPIK3CAPIK3CDRAF1BRAF
SCHEMBL2369564 0.94 MTOR (0.49) MTORPIK3CAPIK3CDPIK3R1CYP3A4
SCHEMBL2370378 0.94 MTOR (0.49) MTORPIK3CAPIK3CDPIK3R1CYP3A4
SCHEMBL2369937 0.88 PIK3CA (0.44) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL2369940 0.88 PIK3CA (0.44) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL2370736 0.84 PIK3CA (0.58) MTORPIK3CAPIK3CDRAF1BRAF
SCHEMBL2370739 0.84 PIK3CA (0.58) MTORPIK3CAPIK3CDRAF1BRAF
SCHEMBL2369980 0.79 PIK3CA (0.54) MTORPIK3CAPIK3CDCYP3A4
SCHEMBL2369991 0.79 PIK3CA (0.54) MTORPIK3CAPIK3CDCYP3A4
SCHEMBL443333 0.78 MTOR (0.55) MTORPIK3CACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130196982-A1 MORPHOLINO SUBSTITUTED UREA DERIVATIVES AS MTOR INHIBITORS CELLZOME LIMITED (GB) 2013-08-01 US claimed
EP-2542536-A1 MORPHOLINO SUBSTITUTED UREA DERIVATIVES AS MTOR INHIBITORS Cellzome Limited (GB) 2013-01-09 EP claimed
WO-2011107585-A1 MORPHOLINO SUBSTITUTED UREA DERIVATIVES AS MTOR INHIBITORS CELLZOME LIMITED (GB) 2011-09-09 WO claimed
US-9249129-B2 Morpholino substituted urea derivatives as mTOR inhibitors CELLZOME LIMITED (GB) 2016-02-02 US disclosed
EP-2542536-B1 Morpholino substituted urea derivatives as mtor inhibitors CELLZOME LTD (GB) 2015-01-21 EP disclosed
US-20130196982-A1 MORPHOLINO SUBSTITUTED UREA DERIVATIVES AS MTOR INHIBITORS CELLZOME LIMITED (GB) 2013-08-01 US disclosed
EP-2542536-A1 MORPHOLINO SUBSTITUTED UREA DERIVATIVES AS MTOR INHIBITORS Cellzome Limited (GB) 2013-01-09 EP disclosed
WO-2011107585-A1 MORPHOLINO SUBSTITUTED UREA DERIVATIVES AS MTOR INHIBITORS CELLZOME LIMITED (GB) 2011-09-09 WO 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-20130196982-A1 MORPHOLINO SUBSTITUTED UREA DERIVATIVES AS MTOR INHIBITORS MTOR, EIF4E, EIF4A1 MTOR 1/4885PIK3CA 347/4885PIK3CD 562/4885

“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.