SCHEMBL5750189

SCHEMBL5750189

Cc1ccnc(Nc2cc3ccc4cccc5ccc(c2)c3c45)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 7/20 0.46
KDR P35968 2/20 0.46
MAPK8 P45983 2/20 0.46
GSK3A P49840 2/20 0.46
MAP4K4 O95819 1/20 0.46
ABL1 P00519 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
IGF1R P08069 1/20 0.46
LTK P29376 1/20 0.46
MAP2K2 P36507 1/20 0.46
MAPK9 P45984 1/20 0.46
CLK2 P49760 1/20 0.46
GSK3B P49841 1/20 0.46
CDK7 P50613 1/20 0.46
CDK9 P50750 1/20 0.46
CDK5 Q00535 1/20 0.46
MAP2K1 Q02750 1/20 0.46
ACVR1 Q04771 1/20 0.46
PTK2 Q05397 1/20 0.46

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
SCHEMBL5748170 0.83 MAPK10 (0.56) KDRMAPK8GSK3AMAP4K4ABL1
SCHEMBL5771191 0.81 MAPK10 (0.51) KARS1KDRMAPK8GSK3AMAP4K4
SCHEMBL5748905 0.81 RIOK2 (0.47) KARS1LCKIGF1RMAPK9CDK5
SCHEMBL5748311 0.81 KMT2A (0.45) KARS1KDRMAPK8GSK3AMAP4K4
SCHEMBL5748045 0.79 KMT2A (0.49) KDRIGF1RKMT2AMEN1NPC1
SCHEMBL5750225 0.79 RIOK2 (0.38) KARS1GSK3AIGF1RMAPK9GSK3B
SCHEMBL18772775 0.78 TNNI3K (0.59) KARS1KDRABL1KMT2AMEN1
SCHEMBL5745780 0.76 TRPV1 (0.37) KARS1MAPK9NPC1RAB9ACASP3
SCHEMBL5751084 0.76 NOS2 (0.57) KDRMAPK8GSK3AMAP4K4ABL1
SCHEMBL5750033 0.76 IGF1R (0.55) KDRMAPK8GSK3AMAP4K4ABL1

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-20060293503-A1 Polyaminopyridines and method for producing same SUMITOMO SEIKA CHEMICALS CO., LTD (JP) 2006-12-28 US disclosed
EP-1669390-A1 POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2006-06-14 EP disclosed