SCHEMBL14843227

SCHEMBL14843227

O=C(Nc1ccc(-c2nc3c(c(N4CC5CCC(C4)O5)n2)CS(O)(O)C3)cc1)NC1CC1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 16/20 0.67
▸ PIK3CA P42336 13/20 0.65
▸ PIK3CB P42338 1/20 0.53

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
SCHEMBL14843229 0.91 MTOR (0.78) MTORPIK3CAPIK3CB
SCHEMBL14843121 0.90 MTOR (0.57) MTORPIK3CAPIK3CB
SCHEMBL14843203 0.90 MTOR (0.71) MTORPIK3CA
SCHEMBL14843205 0.88 MTOR (0.85) MTORPIK3CA
SCHEMBL14843343 0.87 MTOR (0.72) MTORPIK3CA
SCHEMBL14843119 0.86 MTOR (0.64) MTORPIK3CA
SCHEMBL14843221 0.86 MTOR (0.71) MTORPIK3CA
SCHEMBL14843071 0.85 MTOR (0.70) MTORPIK3CA
SCHEMBL14843456 0.85 MTOR (0.69) MTORPIK3CA
SCHEMBL14843471 0.83 MTOR (0.62) MTORPIK3CAPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2763985-B1 {(4-(4-MORPHOLINO-DIHYDROTHIENO[3,4-D]PYRIMIDIN-2-YL)ARYL}UREA OR CARBAMATE DERIVATIVES AS MTOR INHIBITORS CELLZOME LTD (GB) 2016-06-22 — — EP claimed
EP-2763985-A1 MORPHOLINO SUBSTITUTED BICYCLIC PYRIMIDINE UREA OR CARBAMATE DERIVATIVES AS MTOR INHIBITORS Cellzome Limited (GB) 2014-08-13 — — EP claimed
WO-2013050508-A1 MORPHOLINO SUBSTITUTED BICYCLIC PYRIMIDINE UREA OR CARBAMATE DERIVATIVES AS MTOR INHIBITORS CELLZOME LIMITED (GB) 2013-04-11 — — WO claimed
EP-2763985-A1 MORPHOLINO SUBSTITUTED BICYCLIC PYRIMIDINE UREA OR CARBAMATE DERIVATIVES AS MTOR INHIBITORS Cellzome Limited (GB) 2014-08-13 — — EP disclosed
WO-2013050508-A1 MORPHOLINO SUBSTITUTED BICYCLIC PYRIMIDINE UREA OR CARBAMATE DERIVATIVES AS MTOR INHIBITORS CELLZOME LIMITED (GB) 2013-04-11 — — WO disclosed
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