SCHEMBL1409520

SCHEMBL1409520

C[C@H]1COCCN1c1nc(Cl)nc(N2CCOCC2)n1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTOR P42345 17/20 0.56
PIK3CA P42336 11/20 0.54
RICTOR Q6R327 3/20 0.54
RPTOR Q8N122 3/20 0.54
MAPKAP1 Q9BPZ7 3/20 0.54
MLST8 Q9BVC4 3/20 0.54
PIK3R1 P27986 4/20 0.53
PIK3CG P48736 1/20 0.53
MAPT P10636 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
AKT1 P31749 1/20 0.44

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
SCHEMBL21029901 1.00 MTOR (0.56) MTORPIK3CARICTORRPTORMAPKAP1
SCHEMBL29727937 1.00 MTOR (0.56) MTORPIK3CARICTORRPTORMAPKAP1
SCHEMBL28977909 1.00 MTOR (0.56) MTORPIK3CARICTORRPTORMAPKAP1
SCHEMBL19629401 0.92 MTOR (0.53) MTORPIK3CARICTORRPTORMAPKAP1
SCHEMBL21029958 0.92 MTOR (0.53) MTORPIK3CARICTORRPTORMAPKAP1
SCHEMBL20692837 0.92 MTOR (0.53) MTORPIK3CARICTORRPTORMAPKAP1
SCHEMBL21394004 0.92 MTOR (0.53) MTORPIK3CARICTORRPTORMAPKAP1
SCHEMBL10124249 0.89 MTOR (0.50) MTORPIK3CAPIK3R1
SCHEMBL14811270 0.89 MTOR (0.50) MTORPIK3CAPIK3R1
SCHEMBL14811271 0.89 MTOR (0.50) MTORPIK3CAPIK3R1

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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114751899-B Diaryl urea mTOR kinase inhibitor, and pharmaceutical composition and application thereof 贵州医科大学 2024-03-29 CN disclosed
CN-116102545-A Diaryl urea PI3K/mTOR/HDAC multi-target inhibitor, and pharmaceutical composition and application thereof 贵州医科大学 2023-05-12 CN disclosed
US-20230014057-A1 TREATMENT OF SKIN DISORDERS TORQUR AG (CH) 2023-01-19 US disclosed
CN-114751899-A Diaryl urea mTOR kinase inhibitor and pharmaceutical composition and application thereof 贵州医科大学 2022-07-15 CN disclosed
US-20220153752-A1 DIFLUOROMETHYL-AMINOPYRIDINES AND DIFLUOROMETHYL-AMINOPYRIMIDINES TORQUR AG (CH) 2022-05-19 US disclosed
US-20220135551-A1 TREATMENT OF NEUROLOGICAL DISORDERS PIQUR THERAPEUTICS AG (CH) 2022-05-05 US disclosed
US-11186591-B2 Difluoromethyl-aminopyridines and difluoromethyl-aminopyrimidines UNIVERSITÄT BASEL (CH) 2021-11-30 US disclosed
US-20210361665-A1 TREATMENT OF SKIN LESIONS TORQUR AG (CH) 2021-11-25 US disclosed
US-10993947-B2 Treatment of skin lesions TORQUR (CH) 2021-05-04 US disclosed
US-20210107913-A1 TREATMENT OF SKIN DISORDERS TORQUR AG (CH) 2021-04-15 US disclosed
US-20130109670-A1 TRIAZINE COMPOUNDS AS PI3 KINASE AND MTOR INHIBITORS PFIZER INC. (US) 2013-05-02 US disclosed
US-20130005723-A1 TRIAZINE COMPOUNDS AS PI3 KINASE AND MTOR INHIBITORS WYETH LLC 2013-01-03 US disclosed
US-8217036-B2 Triazine compounds as PI3 kinase and mTOR inhibitors WYETH LLC (US) 2012-07-10 US disclosed
US-8039469-B2 Triazine compounds as PI3 kinase and mTOR inhibitors WYETH LLC (US) 2011-10-18 US disclosed
EP-2300483-A1 TRIAZINE COMPOUNDS AS P13 KINASE AND MTOR INHIBITORS Wyeth LLC (US) 2011-03-30 EP disclosed
EP-2294072-A1 TRIAZINE COMPOUNDS AS P13 KINASE AND MTOR INHIBITORS Wyeth LLC (US) 2011-03-16 EP disclosed
US-20090304692-A1 Phosphatidylinositol 3 (PI3); Mammalian Target of Rapamycin, mTOR; triazine compounds substituted with either morpholino or tetrahydropyranyl rings on the triazine ring; anticancer agents, atherosclerosis, bone disorders, psoriasis, BPH, pancreatitis, kidney disease WYETH (US) 2009-12-10 US disclosed
WO-2009143317-A1 TRIAZINE COMPOUNDS AS P13 KINASE AND MTOR INHIBITORS WYETH (US) 2009-11-26 WO disclosed
US-20090291079-A1 Phosphatidylinositol 3 (PI3); Mammalian Target of Rapamycin, mTOR; triazine compounds substituted with either morpholino or tetrahydropyranyl rings on the triazine ring; anticancer agents, atherosclerosis, bone disorders, psoriasis, BPH, pancreatitis, kidney disease WYETH (US) 2009-11-26 US disclosed
WO-2009143313-A1 TRIAZINE COMPOUNDS AS P13 KINASE AND MTOR INHIBITORS WYETH (US) 2009-11-26 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 (11 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-20210361665-A1 TREATMENT OF SKIN LESIONS CXCR3, C3AR1, CCR3 MTOR 4061/4885PIK3CA 3770/4885RICTOR 4181/4885
US-20090291079-A1 Phosphatidylinositol 3 (PI3); Mammalian Target of Rapamycin, mTOR; triazine compounds substituted with either morpholino or tetrahydropyranyl rings on the triazine ring; anticancer agents, atherosclerosis, bone disorders, psoriasis, BPH, pancreatitis, kidney disease MTOR, PIK3CA, PIK3R3 MTOR 1/4885PIK3CA 2/4885RICTOR 8/4885
US-20220153752-A1 DIFLUOROMETHYL-AMINOPYRIDINES AND DIFLUOROMETHYL-AMINOPYRIMIDINES PIK3CA, MTOR, PIKFYVE MTOR 2/4885PIK3CA 1/4885RICTOR 31/4885
US-20130109670-A1 TRIAZINE COMPOUNDS AS PI3 KINASE AND MTOR INHIBITORS MTOR, RICTOR, PIK3CA MTOR 1/4885PIK3CA 3/4885RICTOR 2/4885
US-20130005723-A1 TRIAZINE COMPOUNDS AS PI3 KINASE AND MTOR INHIBITORS MTOR, RICTOR, PIK3CA MTOR 1/4885PIK3CA 3/4885RICTOR 2/4885
US-20210107913-A1 TREATMENT OF SKIN DISORDERS RXFP3, CBR3, CXCR3 MTOR 2897/4885PIK3CA 3974/4885RICTOR 2628/4885
US-20220135551-A1 TREATMENT OF NEUROLOGICAL DISORDERS CHRM1, CHRM2, C1R MTOR 4473/4885PIK3CA 4513/4885RICTOR 4018/4885
US-20090304692-A1 Phosphatidylinositol 3 (PI3); Mammalian Target of Rapamycin, mTOR; triazine compounds substituted with either morpholino or tetrahydropyranyl rings on the triazine ring; anticancer agents, atherosclerosis, bone disorders, psoriasis, BPH, pancreatitis, kidney disease MTOR, PIK3CA, PIK3R3 MTOR 1/4885PIK3CA 2/4885RICTOR 8/4885
US-10993947-B2 Treatment of skin lesions CXCR3, CCR3, C3AR1 MTOR 4107/4885PIK3CA 3971/4885RICTOR 4301/4885
US-20230014057-A1 TREATMENT OF SKIN DISORDERS RXFP3, CCR3, CBR3 MTOR 3212/4885PIK3CA 4158/4885RICTOR 2879/4885
US-11186591-B2 Difluoromethyl-aminopyridines and difluoromethyl-aminopyrimidines PIK3CA, MTOR, PIKFYVE MTOR 2/4885PIK3CA 1/4885RICTOR 31/4885

“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.