SCHEMBL6903480

SCHEMBL6903480

Cc1ccnc(C2COC(=O)N2C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTOR P42345 2/20 0.42
CCR1 P32246 1/20 0.42
CCR5 P51681 1/20 0.42
CCR8 P51685 1/20 0.42
CXCR4 P61073 1/20 0.36
CYP2A6 P11509 1/20 0.36
TSHR P16473 1/20 0.35
IDH1 O75874 5/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
UHRF1 Q96T88 1/20 0.34
TERT O14746 1/20 0.34
DPP4 P27487 3/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL10308871 0.82 MTOR (0.40) MTORCCR1CCR5CCR8CYP2A6
SCHEMBL10308934 0.79 IDH1 (0.48) MTORIDH1ALDH1A1NPC1RAB9A
SCHEMBL16181420 0.78 MTOR (0.38) MTORCCR1CCR5CCR8CXCR4
SCHEMBL6902761 0.74 MTOR (0.44) MTORIDH1TERT
SCHEMBL6903482 0.73 MTOR (0.42) MTORIDH1LMNASMN1; SMN2MAPT
SCHEMBL6902382 0.71 MTOR (0.37) MTORIDH1ALDH1A1SMN1; SMN2
SCHEMBL6904739 0.70 MTOR (0.43) MTORIDH1
SCHEMBL6902729 0.69 TNKS (0.39) MTORTSHRIDH1ALDH1A1CYP3A4
SCHEMBL6902759 0.69 MAPK1 (0.40) MTORALDH1A1LMNANPC1RAB9A
SCHEMBL31494788 0.69 CCR1 (0.39) MTORCCR1CCR5CCR8CYP2A6

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 1/4885CCR1 3602/4885CCR5 4079/4885

“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.