SCHEMBL13616150

SCHEMBL13616150

CC1CN(C2CCCC2)c2nc(Nc3ccc4[nH]ccc4c3)ncc21

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 3/20 0.46
SYK P43405 4/20 0.45
EGFR P00533 8/20 0.44
IGF1R P08069 1/20 0.43
WEE1 P30291 1/20 0.41
PLK2 Q9NYY3 3/20 0.40
LCK P06239 1/20 0.39
KIT P10721 1/20 0.39
FGFR3 P22607 1/20 0.39
FLT3 P36888 1/20 0.39
PLK1 P53350 1/20 0.39
RPS6KA1 Q15418 1/20 0.39
PIM3 Q86V86 1/20 0.39
WNK2 Q9Y3S1 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
SCHEMBL13616799 0.86 CDC7 (0.50) ULK1SYKEGFRIGF1RWEE1
SCHEMBL13616147 0.83 JAK1 (0.43) PLK1
SCHEMBL13616093 0.77 RPS6KA6 (0.59) FGFR3
SCHEMBL13616167 0.76 CDK2 (0.57) PLK2PLK1
SCHEMBL11976974 0.75 RPS6KA6 (0.59) EGFRWEE1KITFGFR3FLT3
SCHEMBL13616293 0.74 CDK4 (0.60) EGFRWEE1KITFGFR3FLT3
SCHEMBL1675717 0.74 PLK1 (0.61) ULK1SYKEGFRPLK2LCK
SCHEMBL12631916 0.73 AURKA (0.55) ULK1SYKIGF1RPLK2LCK
SCHEMBL4783750 0.73 PLK1 (0.52) ULK1SYKEGFRIGF1RPLK2
SCHEMBL11977085 0.72 EGFR (0.48) ULK1SYKEGFRIGF1RPLK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324225-B2 Pyrrolopyrimidine compounds and their uses NOVARTIS AG (CH) 2012-12-04 US disclosed
US-20090318441-A1 Pyrrolopyrimidine Compounds and Their Uses ASTEX THERAPEUTICS LTD. 2009-12-24 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-20090318441-A1 Pyrrolopyrimidine Compounds and Their Uses PRKDC, TK2, PNKP ULK1 467/4885SYK 1001/4885EGFR 1900/4885

“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.