SCHEMBL987180

SCHEMBL987180

CNC(=O)Nc1ccc(-c2nc(N3CC4CCC(C3)O4)c3c(n2)C(C)(C)CO3)cc1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MTOR P42345 18/20 0.61
PIK3CA P42336 16/20 0.61
PIK3CD O00329 1/20 0.55
PIK3R1 P27986 1/20 0.55
SMG1 Q96Q15 1/20 0.55

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
SCHEMBL988219 0.84 MTOR (0.61) MTORPIK3CAPIK3CD
SCHEMBL986698 0.82 MTOR (0.66) MTORPIK3CAPIK3CDPIK3R1SMG1
SCHEMBL982909 0.82 MTOR (0.66) MTORPIK3CAPIK3CDPIK3R1SMG1
SCHEMBL986301 0.81 MTOR (0.41) MTORPIK3CA
SCHEMBL986009 0.79 MTOR (0.63) MTORPIK3CAPIK3CDPIK3R1SMG1
SCHEMBL1409258 0.78 MTOR (0.66) MTORPIK3CAPIK3R1
SCHEMBL628342 0.77 PIK3CA (0.69) MTORPIK3CAPIK3CDPIK3R1SMG1
SCHEMBL2442143 0.76 MTOR (0.58) MTORPIK3CAPIK3CDPIK3R1SMG1
SCHEMBL3721782 0.76 MTOR (0.63) MTORPIK3CAPIK3CDPIK3R1SMG1
SCHEMBL55907 0.76 MTOR (1.00) MTORPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012099581-A1 DIHYDROFUROPYRIMIDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-07-26 WO claimed
US-20110021515-A1 DIHYROFUROPYRMINDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-27 US claimed
WO-2012099581-A1 DIHYDROFUROPYRIMIDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-07-26 WO disclosed
WO-2012099581-A1 DIHYDROFUROPYRIMIDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-07-26 WO disclosed
US-20110021515-A1 DIHYROFUROPYRMINDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-27 US disclosed
US-20110021515-A1 DIHYROFUROPYRMINDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-27 US disclosed
US-20110021515-A1 DIHYROFUROPYRMINDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-27 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-20110021515-A1 DIHYROFUROPYRMINDINE COMPOUNDS MTOR, RICTOR, DEPTOR MTOR 1/4885PIK3CA 59/4885PIK3CD 42/4885

“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.