SCHEMBL1108250

SCHEMBL1108250

Fc1cc2cc(c1)-c1ccnc(n1)Nc1ccc(OCCCN3CCCC3)c(c1)COC/C=C/CCO2

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 20/20 0.73
FLT3 P36888 20/20 0.73
TYK2 P29597 16/20 0.73
CDK2 P24941 14/20 0.73
JAK1 P23458 14/20 0.73
CCNA2 P20248 7/20 0.73
CCNA1 P78396 7/20 0.73
JAK3 P52333 14/20 0.71
KCNH2 Q12809 2/20 0.71
CYP2D6 P10635 2/20 0.63
CSF1R P07333 3/20 0.62
CDK9 P50750 2/20 0.62
GAK O14976 1/20 0.62
STK16 O75716 1/20 0.62
STK10 O94804 1/20 0.62
MAP4K4 O95819 1/20 0.62
PRKCB P05771 1/20 0.62
LCK P06239 1/20 0.62
PDGFRB P09619 1/20 0.62
NQO2 P16083 1/20 0.62

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
SCHEMBL1108288 0.96 JAK2 (0.79) JAK2FLT3TYK2CDK2JAK1
SCHEMBL1108251 0.90 JAK2 (0.75) JAK2FLT3TYK2CDK2JAK1
SCHEMBL14022931 0.87 JAK2 (0.93) JAK2FLT3TYK2CDK2JAK1
SCHEMBL14022839 0.87 JAK2 (0.93) JAK2FLT3TYK2CDK2JAK1
SCHEMBL823995 0.86 JAK2 (0.81) JAK2FLT3TYK2CDK2JAK1
SCHEMBL1108241 0.85 JAK2 (0.67) JAK2FLT3TYK2CDK2JAK1
SCHEMBL14538612 0.85 JAK2 (0.61) JAK2FLT3TYK2CDK2JAK1
SCHEMBL1108285 0.85 JAK2 (1.00) JAK2FLT3TYK2CDK2JAK1
SCHEMBL824038 0.84 JAK2 (0.82) JAK2FLT3TYK2CDK2JAK1
SCHEMBL1108286 0.84 JAK2 (0.81) JAK2FLT3TYK2CDK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153632-B2 Oxygen linked pyrimidine derivatives S*BIO PTE LTD. (SG) 2012-04-10 US disclosed
US-8153632-B2 Oxygen linked pyrimidine derivatives S*BIO PTE LTD. (SG) 2012-04-10 US disclosed
US-20090075999-A1 OXYGEN LINKED PYRIMIDINE DERIVATIVES S*BIO PTE LTD. (SG) 2009-03-19 US disclosed
US-20090075999-A1 OXYGEN LINKED PYRIMIDINE DERIVATIVES S*BIO PTE LTD. (SG) 2009-03-19 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-20090075999-A1 OXYGEN LINKED PYRIMIDINE DERIVATIVES DPYD, TK2, TK1 JAK2 468/4885FLT3 645/4885TYK2 960/4885

“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.