SCHEMBL1781996

SCHEMBL1781996

Cc1oncc1C(=O)Nc1cc(N2CCN(C)CC2)ccc1C(=O)Nc1n[nH]c2sc(C(=O)NC(C)(C)c3ccccc3)cc12

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AURKA O14965 7/20 0.54
ABL1 P00519 2/20 0.52
BCR P11274 2/20 0.52
INSR P06213 4/20 0.43
ALK Q9UM73 4/20 0.43
IGF1R P08069 2/20 0.43
RAF1 P04049 1/20 0.42
CSF1R P07333 1/20 0.42
LYN P07948 1/20 0.42
BRAF P15056 1/20 0.42
FLT3 P36888 4/20 0.41
SIRT6 Q8N6T7 1/20 0.40
LCK P06239 1/20 0.40
KDR P35968 1/20 0.40
MAPK14 Q16539 1/20 0.40
KIT P10721 2/20 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
SCHEMBL1779553 0.91 AURKA (0.44) AURKAABL1BCRINSRALK
SCHEMBL15362115 0.90 AURKA (0.46) AURKAABL1BCRINSRALK
SCHEMBL3868337 0.89 CSF1R (0.45) AURKAABL1INSRALKIGF1R
SCHEMBL1779217 0.88 AURKA (0.55) AURKAABL1BCRINSRALK
SCHEMBL1781440 0.87 AURKA (0.55) AURKAABL1BCRINSRALK
SCHEMBL1779319 0.86 AURKA (0.41) AURKAABL1BCRCSF1RFLT3
SCHEMBL1779562 0.86 AURKA (0.57) AURKAABL1BCRINSRALK
SCHEMBL1777770 0.85 AURKA (0.55) AURKAABL1BCRINSRALK
SCHEMBL1777677 0.84 AURKA (0.52) AURKAABL1BCRINSRALK
SCHEMBL1780828 0.84 AURKA (0.45) AURKAABL1BCRINSRALK

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-7943654-B2 1H-thieno[2,3-c]pyrazole compounds useful as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-05-17 US claimed
EP-1904503-A1 1H-THIENO[2,3-C]-PYRAZOLE COMPOUNDS USEFUL AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2008-04-02 EP claimed
WO-2007009898-A1 1H-THIENO[2,3-C]PYRAZOLE COMPOUNDS USEFUL AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2007-01-25 WO claimed