SCHEMBL828634

SCHEMBL828634

Cc1c(Oc2ccnc(-c3cnn(C)c3)c2)ccc(NC(=O)Nc2cc(C(C)(C)C)nn2C)c1F.Cn1cc(-c2cc(Oc3ccc(NC(=O)Nc4cc(C(C)(C)C)nn4C)c(F)c3F)ccn2)cn1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 1/20 0.51
MAPK14 Q16539 1/20 0.51
AXL P30530 1/20 0.51
CSF1R P07333 14/20 0.50
PDGFRA P16234 12/20 0.50
PDGFRB P09619 9/20 0.50
CYP2C9 P11712 1/20 0.50
BRAF P15056 1/20 0.49
ABL1 P00519 1/20 0.49
KDR P35968 3/20 0.49
NTRK1 P04629 1/20 0.49
RET P07949 1/20 0.49
EPHB2 P29323 1/20 0.49
FLT3 P36888 5/20 0.48
MET P08581 3/20 0.48

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
SCHEMBL573795 0.98 MAPK13 (0.53) MAPK13MAPK14AXLCSF1RPDGFRA
SCHEMBL574170 0.96 MAPK14 (0.54) MAPK13MAPK14AXLCSF1RPDGFRA
SCHEMBL574193 0.91 CSF1R (0.51) MAPK13MAPK14AXLCSF1RPDGFRA
SCHEMBL828171 0.89 CSF1R (0.52) MAPK13MAPK14AXLCSF1RPDGFRA
SCHEMBL828635 0.88 AXL (0.49) AXLCSF1RPDGFRAPDGFRBCYP2C9
SCHEMBL574635 0.87 MAPK14 (0.51) MAPK13MAPK14AXLCSF1RPDGFRA
SCHEMBL2923062 0.87 BRAF (0.56) MAPK14AXLBRAF
SCHEMBL574094 0.85 MAPK14 (0.49) MAPK13MAPK14AXLCSF1RPDGFRA
SCHEMBL828037 0.85 ABL1 (0.50) MAPK13MAPK14AXLCSF1RPDGFRA
SCHEMBL828528 0.85 MAPK14 (0.49) MAPK13MAPK14AXLCSF1RPDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143293-B2 disease caused by c-Abl kinase, c-Kit kinase, oncogenic forms, aberrant fusion proteins and polymorphs; 1-(3-t-butylisoxazol-5-yl)-3-(2-fluoro-4-(2-(1-methyl-1H-pyrazol-4-yl)pyridin-4-yloxy)phenyl)urea DECIPHERA PHARMACEUTICALS, LLC (US) 2012-03-27 US disclosed
US-20080261965-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFIC DISEASES AND OTHER PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2008-10-23 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-20080261965-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFIC DISEASES AND OTHER PROLIFERATIVE DISEASES KIT, PRKACA, BRAF MAPK13 158/4885MAPK14 264/4885AXL 338/4885

“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.