SCHEMBL1779562

SCHEMBL1779562

CN1CCN(c2ccc(C(=O)Nc3n[nH]c4sc(C(=O)NC(C)(C)c5ccccc5)cc34)c(NC(=O)c3ccc[nH]3)c2)CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AURKA O14965 11/20 0.57
ABL1 P00519 2/20 0.55
BCR P11274 2/20 0.55
IGF1R P08069 2/20 0.50
INSR P06213 3/20 0.42
ALK Q9UM73 3/20 0.42
SIRT6 Q8N6T7 1/20 0.41
KIT P10721 2/20 0.40
FLT3 P36888 1/20 0.40
AURKB Q96GD4 1/20 0.40

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
SCHEMBL1779963 0.91 IGF1R (0.52) AURKAABL1BCRIGF1RINSR
SCHEMBL3868170 0.90 IGF1R (0.56) AURKAIGF1RINSRALKSIRT6
SCHEMBL1779217 0.88 AURKA (0.55) AURKAABL1BCRIGF1RINSR
SCHEMBL1781440 0.87 AURKA (0.55) AURKAABL1BCRIGF1RINSR
SCHEMBL1779351 0.86 AURKA (0.69) AURKAABL1BCRKITFLT3
SCHEMBL1781996 0.86 AURKA (0.54) AURKAABL1BCRIGF1RINSR
SCHEMBL1778344 0.86 AURKA (0.43) AURKAABL1BCR
SCHEMBL740985 0.85 AURKA (0.77) AURKAABL1BCRKITFLT3
SCHEMBL1777770 0.84 AURKA (0.55) AURKAABL1BCRIGF1RINSR
SCHEMBL1777677 0.84 AURKA (0.52) AURKAABL1BCRIGF1RINSR

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 4 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
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