SCHEMBL166147

SCHEMBL166147

NC(=O)c1ccsc1NC(=O)C(F)(F)c1ccc(F)cc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 13/20 0.60
PTK2 Q05397 1/20 0.52
MAPK10 P53779 2/20 0.48
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
ALOX15 P16050 1/20 0.45
MAPK1 P28482 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL5478399 0.81 PTK2 (0.63) MAPK8PTK2MAPK10NPC1RAB9A
SCHEMBL163856 0.78 MAPK8 (0.45) MAPK8MAPK10NPC1RAB9ASMN1; SMN2
SCHEMBL163466 0.78 JAK2 (0.54)
SCHEMBL159515 0.75 AGTR1 (0.50) MAPK8MAPK10NPC1RAB9ASMN1; SMN2
SCHEMBL167175 0.75 GRIK1 (0.44) MAPK8MAPK10NPC1RAB9ASMN1; SMN2
SCHEMBL18080772 0.74 PTK2 (0.66) MAPK8PTK2MAPK10NPC1RAB9A
SCHEMBL160679 0.73 KCNN4 (0.40) MAPK10
SCHEMBL1680689 0.72 PTK2 (0.73) MAPK8PTK2MAPK10NPC1TP53
SCHEMBL163352 0.71 KCNMA1 (0.45)
SCHEMBL11946878 0.71 PTK2 (0.71) MAPK8PTK2MAPK10NPC1TP53

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-20130317045-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2013-11-28 US disclosed
EP-2611812-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2013-07-10 EP disclosed
WO-2012030894-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2012-03-08 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-20130317045-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF JAK2, JAK3, TYK2 MAPK8 461/4885PTK2 224/4885MAPK10 467/4885

“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.