SCHEMBL1640558

SCHEMBL1640558

Cc1nc(-c2cccc(NC(=O)c3cc(F)ccc3F)c2)c(-c2ccnc(Cl)n2)s1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LCLAT1 Q6UWP7 3/20 0.45
BRAF P15056 4/20 0.44
EGFR P00533 1/20 0.43
MAPT P10636 2/20 0.41
CDK4 P11802 2/20 0.41
CDK2 P24941 2/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPK14 Q16539 1/20 0.41
FADS1 O60427 1/20 0.41
TP53 P04637 1/20 0.41
HTT P42858 1/20 0.40
BTK Q06187 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL1641998 0.90 LCLAT1 (0.46) LCLAT1BRAFEGFRMAPTLMNA
SCHEMBL1640608 0.90 BRAF (0.47) LCLAT1BRAFEGFRMAPTLMNA
SCHEMBL1641904 0.88 BRAF (0.51) BRAFEGFRMAPTCDK4CDK2
SCHEMBL1642305 0.86 LCLAT1 (0.43) LCLAT1BRAFEGFRMAPTLMNA
SCHEMBL1642023 0.86 LCLAT1 (0.47) LCLAT1BRAFEGFRMAPTLMNA
SCHEMBL3422428 0.85 MAPK14 (0.48) MAPTCDK4CDK2MAPK14TP53
SCHEMBL1640619 0.82 LCLAT1 (0.49) LCLAT1BRAFEGFRMAPTLMNA
SCHEMBL1640567 0.79 SLC2A1 (0.49) BRAFEGFRCDK4CDK2
SCHEMBL12726655 0.79 BTK (0.42) BRAFMAPTCDK4CDK2MAPK14
SCHEMBL1640498 0.78 BRAF (0.49) BRAFEGFRMAPTLMNASMN1; SMN2

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 6 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
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 LCLAT1 2338/4885BRAF 151/4885EGFR 478/4885

“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.