SCHEMBL1944155

SCHEMBL1944155

COc1ccc(Cn2nc(OCC3CCN(C(=O)OC(C)(C)C)CC3)c3c(Oc4ccc(N)cc4F)ccnc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.42
GPR119 Q8TDV5 4/20 0.41
ALOX5AP P20292 2/20 0.39
FEN1 P39748 2/20 0.39
BACE1 P56817 2/20 0.39
HDAC1 Q13547 1/20 0.39
ALDH1A1 P00352 1/20 0.37
KDM1A O60341 1/20 0.37
CHEK2 O96017 1/20 0.36
CTSD P07339 1/20 0.36
CTSE P14091 1/20 0.36
SRC P12931 1/20 0.36
TGFBR1 P36897 1/20 0.36
STS P08842 1/20 0.36
HTT P42858 1/20 0.35

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
SCHEMBL1944319 0.91 GPR119 (0.41) GPR119BACE1ALDH1A1KDM1ACTSD
SCHEMBL3114724 0.90 BACE1 (0.39) SLC2A1GPR119BACE1ALDH1A1KDM1A
SCHEMBL3101367 0.89 ALDH1A1 (0.41) BACE1ALDH1A1KDM1ACTSDCTSE
SCHEMBL3106664 0.87 ALDH1A1 (0.45) GPR119BACE1HDAC1ALDH1A1KDM1A
SCHEMBL1945933 0.87 KDM1A (0.39) SLC2A1GPR119BACE1ALDH1A1KDM1A
SCHEMBL1944513 0.87 SRC (0.37) GPR119ALOX5APFEN1BACE1ALDH1A1
SCHEMBL1944514 0.87 SRC (0.37) GPR119ALOX5APFEN1BACE1ALDH1A1
SCHEMBL1944532 0.86 CHEK2 (0.38) KDM1ACHEK2SRC
SCHEMBL1944531 0.86 CHEK2 (0.38) KDM1ACHEK2SRC
SCHEMBL3097478 0.86 KDM1A (0.41) GPR119ALDH1A1KDM1A

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-20110130406-A1 PYRAZOLO-PYRIDINES AS TYROSINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2011-06-02 US disclosed
EP-2193130-A1 PYRAZOLO-PYRIDINES AS TYROSINE KINASE INHIBITORS Array Biopharma, Inc. (US) 2010-06-09 EP disclosed
WO-2009033084-A1 PYRAZOLO-PYRIDINES AS TYROSINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2009-03-12 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-20110130406-A1 PYRAZOLO-PYRIDINES AS TYROSINE KINASE INHIBITORS TYRO3, LCK, LTK SLC2A1 1976/4885GPR119 420/4885ALOX5AP 3722/4885

“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.