SCHEMBL1590820

SCHEMBL1590820

NC1CCC(Nc2nc(Nc3ccc(C(=O)N4CCCCC4)cc3)c3ncn(-c4ccccc4)c3n2)CC1

nearest known ligand 0.83

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 14/20 0.58
FLT3 P36888 10/20 0.58
CDK2 P24941 8/20 0.58
SRC P12931 1/20 0.56
CCNE1 P24864 4/20 0.54

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
SCHEMBL12727080 1.00 PDGFRA (0.58) PDGFRAFLT3CDK2SRCCCNE1
SCHEMBL1591420 0.90 FLT3 (0.56) PDGFRAFLT3CDK2SRCCCNE1
SCHEMBL23468403 0.89 FLT3 (0.55) PDGFRAFLT3CDK2SRCCCNE1
SCHEMBL4565801 0.87 CDK2 (0.48) PDGFRAFLT3CDK2SRCCCNE1
SCHEMBL3585775 0.84 CDK1 (0.54) PDGFRAFLT3CDK2SRCCCNE1
SCHEMBL1590863 0.81 NPC1 (0.50) CDK2
SCHEMBL13444871 0.81 FLT3 (0.73) PDGFRAFLT3CDK2SRCCCNE1
SCHEMBL1590688 0.80 FLT3 (0.52) PDGFRAFLT3CDK2SRCCCNE1
SCHEMBL1590850 0.79 HPGD (0.46) CDK2SRCCCNE1
SCHEMBL14097812 0.78 PDGFRA (0.42) PDGFRAFLT3CDK2SRCCCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110092491-A1 Compounds and Compositions as Inhibitors of Receptor Tyrosine Kinase Activity NOVARTIS AG (CH) 2011-04-21 US disclosed
US-20100056494-A1 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2010-03-04 US disclosed
EP-2124954-A2 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2009-12-02 EP disclosed
WO-2008094737-A2 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2008-08-07 WO disclosed
US-20050124637-A1 Compounds and compositions as inhibitors of receptor tyrosine kinase activity IRM LLC (BM) 2005-06-09 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 (3 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-20050124637-A1 Compounds and compositions as inhibitors of receptor tyrosine kinase activity BMX, LCK, FYN PDGFRA 35/4885FLT3 5/4885CDK2 444/4885
US-20100056494-A1 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES ADK, PNP, DCK PDGFRA 1321/4885FLT3 317/4885CDK2 276/4885
US-20110092491-A1 Compounds and Compositions as Inhibitors of Receptor Tyrosine Kinase Activity BMX, LCK, FYN PDGFRA 35/4885FLT3 5/4885CDK2 444/4885

“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.