SCHEMBL1779963

SCHEMBL1779963

CN1CCN(c2ccc(C(=O)Nc3n[nH]c4sc(C(=O)NC(C)(C)c5ccccc5F)cc34)c(NC(=O)c3ccc[nH]3)c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 10/20 0.52
AURKA O14965 5/20 0.47
ABL1 P00519 1/20 0.45
BCR P11274 1/20 0.45
INSR P06213 14/20 0.42
ALK Q9UM73 14/20 0.42
KIT P10721 1/20 0.40
FLT3 P36888 1/20 0.40
AURKB Q96GD4 3/20 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
SCHEMBL1779562 0.91 AURKA (0.57) IGF1RAURKAABL1BCRINSR
SCHEMBL15362116 0.91 IGF1R (0.49) IGF1RAURKAABL1BCRINSR
SCHEMBL1779993 0.88 AURKA (0.45) IGF1RAURKAABL1BCRINSR
SCHEMBL1779339 0.87 INSR (0.45) IGF1RAURKAABL1BCRINSR
SCHEMBL1779553 0.87 AURKA (0.44) IGF1RAURKAABL1BCRINSR
SCHEMBL3868170 0.86 IGF1R (0.56) IGF1RAURKAINSRALKKIT
SCHEMBL1779132 0.86 NR1H4 (0.37) IGF1RAURKAABL1BCRFLT3
SCHEMBL742121 0.86 AURKA (0.62) IGF1RAURKAABL1BCRINSR
SCHEMBL1778772 0.85 INSR (0.47) IGF1RAURKAABL1BCRINSR
SCHEMBL1780489 0.85 AURKA (0.42) IGF1RAURKAABL1BCRINSR

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 2 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
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 disclosed