SCHEMBL1640324

SCHEMBL1640324

Nc1nc(-c2cccc(C(=O)Nc3c(F)cccc3F)c2)c(-c2ccnc(Cl)n2)s1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 9/20 0.52
TGFBR1 P36897 2/20 0.43
INSR P06213 2/20 0.40
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
BRAF P15056 3/20 0.39
MAPK14 Q16539 3/20 0.39
RORB Q92753 1/20 0.38
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38
KCNQ3 O43525 1/20 0.38
KCNQ2 O43526 1/20 0.38
KCNQ5 Q9NR82 1/20 0.38

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
SCHEMBL1639294 0.83 BRAF (0.49) IGF1RTGFBR1INSRBRAFRORB
SCHEMBL1640575 0.81 BRAF (0.43) TGFBR1BRAFRORB
SCHEMBL1640608 0.79 BRAF (0.47) TGFBR1BRAF
SCHEMBL1641849 0.78 IGF1R (0.56) IGF1RINSR
SCHEMBL310451 0.77 IGF1R (0.65) IGF1RINSRBRAFMAPK14
SCHEMBL1641974 0.77 IGF1R (0.70) IGF1RINSRBRAFMAPK14
SCHEMBL1642022 0.77 IGF1R (0.69) IGF1RINSRBRAF
SCHEMBL1640122 0.76 TGFBR1 (0.41) TGFBR1BRAFRORB
SCHEMBL24761211 0.76 TGFBR1 (0.67) TGFBR1ADORA2AADORA1RORB
SCHEMBL1641824 0.76 TGFBR1 (0.55) TGFBR1MAPK14

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-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 US disclosed
US-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 US disclosed
US-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 US disclosed
EP-2231625-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS GlaxoSmithKline LLC (US) 2010-09-29 EP disclosed
WO-2009076140-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-06-18 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-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors PDXK, MAP3K1, MAP4K2 IGF1R 396/4885TGFBR1 1627/4885INSR 589/4885

“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.