SCHEMBL2215099

SCHEMBL2215099

CC(=O)Nc1cccc(-c2cccc(-c3cc4ccnn4c(Nc4ccc(NC(=O)c5ccc(CN)cc5)cc4)n3)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
MCL1 Q07820 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KIT P10721 1/20 0.42
PDGFRA P16234 1/20 0.42
AKT1 P31749 3/20 0.42
AKT2 P31751 3/20 0.42
AKT3 Q9Y243 3/20 0.42
CYP2C9 P11712 2/20 0.42
JAK2 O60674 1/20 0.42
RAD52 P43351 1/20 0.41
PLK1 P53350 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.40
SIRT1 Q96EB6 1/20 0.40
SIRT3 Q9NTG7 1/20 0.40
CYP17A1 P05093 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
PTGIR P43119 1/20 0.39
BTK Q06187 1/20 0.39

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
SCHEMBL2215002 0.96 JAK2 (0.45) POLBMCL1TDP1KITPDGFRA
SCHEMBL2214589 0.91 HDAC1 (0.45) POLBKITPDGFRANPC1RAB9A
SCHEMBL2214475 0.91 JAK2 (0.43) POLBMCL1TDP1JAK2RAD52
SCHEMBL2214976 0.88 MAPT (0.47) POLBMEN1KMT2ANPC1GAA
SCHEMBL2214607 0.87 PLAU (0.46) POLBCYP2C9MEN1KMT2ANPC1
SCHEMBL2211305 0.87 NAMPT (0.47) POLBMCL1TDP1AKT1AKT2
SCHEMBL2211981 0.86 HDAC1 (0.45) POLBKITPDGFRAMEN1KMT2A
SCHEMBL2214363 0.84 HDAC1 (0.42) KITPDGFRAMEN1KMT2ANPC1
SCHEMBL2215189 0.84 PLAU (0.50) POLBMEN1KMT2ANPC1GAA
SCHEMBL2881428 0.83 FYN (0.51) POLBRAD52PLK1CYP17A1CYP11B1

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
EP-1797096-B1 PYRAZOLOPYRIMIDINES AS INHIBITORS OF PROTEIN KINASE B (AKT) BAYER SCHERING PHARMA AG (DE) 2011-07-27 EP disclosed
US-7745446-B2 Pyrazolo[1,5-c]pyrimidines BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-06-29 US disclosed
US-20070254046-A1 Novel Pyrazolopyrimidines ALTANA PHARMA AG (DE) 2007-11-01 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-20070254046-A1 Novel Pyrazolopyrimidines MCL1, RARS2, CDK4 POLB 828/4885MCL1 1/4885TDP1 167/4885

“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.