SCHEMBL2492457

SCHEMBL2492457

Nc1cnc(Nc2ccc(S(=O)(=O)CCCN3CCCC3)cc2)nc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SRC P12931 10/20 0.49
LOX P28300 1/20 0.47
ABL1 P00519 3/20 0.47
PDGFRB P09619 1/20 0.47
CDK4 P11802 1/20 0.46
CDK2 P24941 1/20 0.46
EPHX2 P34913 2/20 0.43
BRD4 O60885 1/20 0.41
HRH3 Q9Y5N1 3/20 0.41
KCNH2 Q12809 1/20 0.40

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
SCHEMBL5437861 0.86 SRC (0.48) SRCLOXABL1PDGFRBCDK4
SCHEMBL2498540 0.82 IGF1R (0.48) HRH3
SCHEMBL2496663 0.81 SRC (0.59) SRCABL1PDGFRB
SCHEMBL14304331 0.79 LOX (0.60) LOXEPHX2HRH3KCNH2
SCHEMBL5442287 0.79 SRC (0.45) SRCLOXABL1PDGFRBCDK4
SCHEMBL5442293 0.79 SRC (0.45) SRCLOXABL1PDGFRBCDK4
SCHEMBL5996778 0.79 SRC (0.56) SRCABL1PDGFRBCDK2BRD4
SCHEMBL5998026 0.78 LCK (0.57) SRCABL1PDGFRBCDK4CDK2
SCHEMBL12212561 0.78 SRC (0.46) SRCABL1PDGFRBEPHX2
SCHEMBL5997334 0.77 KDR (0.48) SRCABL1PDGFRBEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030487-B2 2-amino—5-substituted pyrimidine inhibitors TARGEGEN, INC. (US) 2011-10-04 US disclosed
US-8030487-B2 2-amino—5-substituted pyrimidine inhibitors TARGEGEN, INC. (US) 2011-10-04 US disclosed
US-8030487-B2 2-amino—5-substituted pyrimidine inhibitors TARGEGEN, INC. (US) 2011-10-04 US disclosed
US-20080027070-A1 2-AMINO--5-SUBSTITUTED PYRIMIDINE INHIBITORS TARGEGEN, INC. (US) 2008-01-31 US disclosed
US-20080027070-A1 2-AMINO--5-SUBSTITUTED PYRIMIDINE INHIBITORS TARGEGEN, INC. (US) 2008-01-31 US disclosed
US-20080027070-A1 2-AMINO--5-SUBSTITUTED PYRIMIDINE INHIBITORS TARGEGEN, INC. (US) 2008-01-31 US disclosed
US-20060247250-A1 Pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2006-11-02 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 (2 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-20060247250-A1 Pyrimidine inhibitors of kinases DTYMK, SRC, DCK SRC 2/4885LOX 3047/4885ABL1 12/4885
US-20080027070-A1 2-AMINO--5-SUBSTITUTED PYRIMIDINE INHIBITORS KDR, FLT4, FLT1 SRC 5/4885LOX 1463/4885ABL1 6/4885

“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.