SCHEMBL6902382

SCHEMBL6902382

CN1C(=O)OCC1c1ccc(Cl)cn1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTOR P42345 1/20 0.37
ALDH1A1 P00352 1/20 0.34
TRPA1 O75762 1/20 0.34
IDH1 O75874 4/20 0.33
PTK2 Q05397 1/20 0.33
PDE10A Q9Y233 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
P2RX7 Q99572 1/20 0.32

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
SCHEMBL16181420 0.84 MTOR (0.38) MTORPDE10A
SCHEMBL6903482 0.82 MTOR (0.42) MTORIDH1PDE10ASMN1; SMN2
SCHEMBL10308841 0.82 IDH1 (0.36) MTORALDH1A1IDH1
SCHEMBL6903019 0.79 MTOR (0.40) MTORALDH1A1IDH1SMN1; SMN2L3MBTL1
SCHEMBL3652982 0.76 CHRNA7 (0.43) ALDH1A1SMN1; SMN2
SCHEMBL3652984 0.76 CHRNA7 (0.43) ALDH1A1SMN1; SMN2
SCHEMBL3654550 0.76 CHRNA7 (0.43) ALDH1A1SMN1; SMN2
SCHEMBL10308934 0.76 IDH1 (0.48) MTORALDH1A1IDH1
SCHEMBL6904739 0.72 MTOR (0.43) MTORIDH1
SCHEMBL6902761 0.71 MTOR (0.44) MTORIDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8865726-B2 Substituted pyrazolo[1,5-a]pyrimidine compounds as mTOR inhibitors ARRAY BIOPHARMA INC. (US) 2014-10-21 US disclosed
US-20120178715-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS ARRAY BIOPHARMA INC. (US) 2012-07-12 US disclosed
WO-2011029027-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS ARRAY BIOPHARMA INC. (US) 2011-03-10 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-20120178715-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS MTOR, RICTOR, EIF4EBP1 MTOR 1/4885ALDH1A1 3286/4885TRPA1 4120/4885

“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.