SCHEMBL1641998

SCHEMBL1641998

O=C(Nc1cccc(-c2nc(Br)sc2-c2ccnc(Cl)n2)c1)c1cc(F)ccc1F

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LCLAT1 Q6UWP7 3/20 0.46
BRAF P15056 4/20 0.44
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
FADS1 O60427 1/20 0.41
EGFR P00533 2/20 0.40
BTK Q06187 2/20 0.40
MAPT P10636 2/20 0.39
MAPK1 P28482 1/20 0.39
ERBB2 P04626 1/20 0.39
ABL1 P00519 1/20 0.39
PDGFRB P09619 1/20 0.39
BCR P11274 1/20 0.39
PDGFRA P16234 1/20 0.39
HTT P42858 1/20 0.39
TRPV1 Q8NER1 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
SCHEMBL1640558 0.90 LCLAT1 (0.45) LCLAT1BRAFLMNASMN1; SMN2FADS1
SCHEMBL1640608 0.90 BRAF (0.47) LCLAT1BRAFLMNASMN1; SMN2FADS1
SCHEMBL1640498 0.88 BRAF (0.49) BRAFLMNASMN1; SMN2EGFRBTK
SCHEMBL1642305 0.87 LCLAT1 (0.43) LCLAT1BRAFLMNASMN1; SMN2FADS1
SCHEMBL1642023 0.86 LCLAT1 (0.47) LCLAT1BRAFLMNASMN1; SMN2FADS1
SCHEMBL1640619 0.80 LCLAT1 (0.49) LCLAT1BRAFLMNASMN1; SMN2FADS1
SCHEMBL1639294 0.78 BRAF (0.49) BRAFLMNASMN1; SMN2EGFRMAPT
SCHEMBL1641904 0.78 BRAF (0.51) BRAFLMNASMN1; SMN2EGFRMAPT
SCHEMBL1641680 0.78 BRAF (0.49) BRAFLMNASMN1; SMN2EGFRMAPT
SCHEMBL3442012 0.77 SLC2A1 (0.55) LCLAT1BRAFFADS1EGFRMAPT

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 3 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
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 151/4885LMNA 3516/4885

“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.