SCHEMBL3099014

SCHEMBL3099014

COc1cc(C(=O)Nc2ccc(C)c(Nc3nccc(-c4cccnc4)n3)c2)ccc1S(C)(=O)=O

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 11/20 0.71
ABL1 P00519 11/20 0.71
BCR P11274 8/20 0.71
PDGFRB P09619 5/20 0.71
PRKCA P17252 3/20 0.70
EGFR P00533 1/20 0.69
KDR P35968 1/20 0.67
KIT P10721 5/20 0.66
ABL2 P42684 1/20 0.65

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
SCHEMBL3097525 0.94 ABL1 (0.71) PDGFRAABL1BCRPDGFRBPRKCA
SCHEMBL3104728 0.91 ABL1 (0.76) PDGFRAABL1BCRPDGFRBPRKCA
SCHEMBL3100360 0.91 ABL1 (0.67) PDGFRAABL1BCRPDGFRBPRKCA
SCHEMBL3099734 0.90 ABL1 (0.66) PDGFRAABL1BCRPDGFRBPRKCA
SCHEMBL3104753 0.90 PDGFRA (0.66) PDGFRAABL1BCRPDGFRBPRKCA
SCHEMBL3093548 0.90 ABL1 (0.66) PDGFRAABL1BCRPDGFRBPRKCA
SCHEMBL3100831 0.90 ABL1 (0.68) PDGFRAABL1BCRPDGFRBPRKCA
SCHEMBL3104783 0.90 ABL1 (0.77) PDGFRAABL1BCRPDGFRBPRKCA
SCHEMBL3099866 0.90 ABL1 (0.74) PDGFRAABL1BCRPDGFRBPRKCA
SCHEMBL3100631 0.89 ABL1 (0.64) PDGFRAABL1BCRPDGFRBPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338417-B2 Compounds and compositions as c-kit and PDGFR kinase inhibitors IRM LLC (BM) 2012-12-25 US claimed
US-20100234406-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT AND PDGFR KINASE INHIBITORS IRM LLC (BM) 2010-09-16 US claimed
EP-2152688-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT AND PDGFR KINASE INHIBITORS IRM LLC (BM) 2010-02-17 EP claimed
WO-2008137794-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT AND PDGFR KINASE INHIBITORS IRM LLC (BM) 2008-11-13 WO claimed
US-8338417-B2 Compounds and compositions as c-kit and PDGFR kinase inhibitors IRM LLC (BM) 2012-12-25 US disclosed
US-8338417-B2 Compounds and compositions as c-kit and PDGFR kinase inhibitors IRM LLC (BM) 2012-12-25 US disclosed
US-20100234406-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT AND PDGFR KINASE INHIBITORS IRM LLC (BM) 2010-09-16 US disclosed
US-20100234406-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT AND PDGFR KINASE INHIBITORS IRM LLC (BM) 2010-09-16 US disclosed
EP-2152688-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT AND PDGFR KINASE INHIBITORS IRM LLC (BM) 2010-02-17 EP disclosed
WO-2008137794-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT AND PDGFR KINASE INHIBITORS IRM LLC (BM) 2008-11-13 WO 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-20100234406-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT AND PDGFR KINASE INHIBITORS KIT, PDGFRA, PDGFRB PDGFRA 2/4885ABL1 10/4885BCR 95/4885

“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.