SCHEMBL824062

SCHEMBL824062

COCCOc1ccc2cc1CN(C)C/C=C/CCOc1ccc(s1)-c1ccnc(n1)N2

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 20/20 0.72
CDK2 P24941 20/20 0.72
FLT3 P36888 20/20 0.72
CCNA2 P20248 15/20 0.72
CCNA1 P78396 15/20 0.72
JAK1 P23458 5/20 0.72
TYK2 P29597 5/20 0.72
JAK3 P52333 1/20 0.50
KCNH2 Q12809 1/20 0.50

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
SCHEMBL824065 0.91 JAK2 (0.74) JAK2CDK2FLT3CCNA2CCNA1
SCHEMBL824068 0.85 JAK2 (0.74) JAK2CDK2FLT3CCNA2CCNA1
SCHEMBL823924 0.84 JAK2 (1.00) JAK2CDK2FLT3CCNA2CCNA1
SCHEMBL823870 0.84 JAK2 (1.00) JAK2CDK2FLT3CCNA2CCNA1
SCHEMBL823954 0.83 JAK2 (0.81) JAK2CDK2FLT3CCNA2CCNA1
SCHEMBL824006 0.77 JAK2 (0.74) JAK2CDK2FLT3CCNA2CCNA1
SCHEMBL14531002 0.77 JAK2 (0.87) JAK2CDK2FLT3CCNA2CCNA1
SCHEMBL823918 0.77 JAK2 (1.00) JAK2CDK2FLT3CCNA2CCNA1
SCHEMBL823868 0.77 JAK2 (1.00) JAK2CDK2FLT3CCNA2CCNA1
SCHEMBL823861 0.77 JAK2 (0.79) JAK2CDK2FLT3CCNA2CCNA1

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-8143255-B2 Heteroalkyl linked pyrimidine derivatives S*BIO PTE LTD. (SG) 2012-03-27 US disclosed
US-8143255-B2 Heteroalkyl linked pyrimidine derivatives S*BIO PTE LTD. (SG) 2012-03-27 US disclosed
US-20090258886-A1 HETEROALKYL LINKED PYRIMIDINE DERIVATIVES S*BIO PTE LTD. (SG) 2009-10-15 US disclosed
US-20090258886-A1 HETEROALKYL LINKED PYRIMIDINE DERIVATIVES S*BIO PTE LTD. (SG) 2009-10-15 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-20090258886-A1 HETEROALKYL LINKED PYRIMIDINE DERIVATIVES TK1, TK2, DPYD JAK2 692/4885CDK2 13/4885FLT3 424/4885

“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.