SCHEMBL4256486

SCHEMBL4256486

Cn1ccnc1C=NCCN=Cc1nccn1C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPO P22079 1/20 0.39
PTP4A3 O75365 1/20 0.36
HTT P42858 1/20 0.36
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
FDPS P14324 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRNA4 P43681 1/20 0.30

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
SCHEMBL4259643 1.00 LPO (0.39) LPOPTP4A3HTTMEN1KMT2A
SCHEMBL14769326 0.88 ALDH1A1 (0.39) LPOPTP4A3HTTMEN1KMT2A
SCHEMBL14769322 0.86 LPO (0.32) LPOPTP4A3
SCHEMBL14769323 0.86 LPO (0.32) LPOPTP4A3HTTMEN1KMT2A
SCHEMBL14769324 0.84 HTT (0.36) LPOPTP4A3HTTMEN1KMT2A
SCHEMBL1254916 0.81 LPO (0.43) LPOPTP4A3HTTMEN1KMT2A
SCHEMBL19999314 0.79
SCHEMBL2834448 0.78
SCHEMBL5206030 0.78
SCHEMBL10469226 0.78

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-8268933-B2 Polymers functionalized with polyimine compounds BRIDGESTONE CORPORATION (JP) 2012-09-18 US claimed
US-20090171035-A1 POLYMERS FUNCTIONALIZED WITH POLYIMINE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2009-07-02 US claimed
US-8268933-B2 Polymers functionalized with polyimine compounds BRIDGESTONE CORPORATION (JP) 2012-09-18 US disclosed
US-20090171035-A1 POLYMERS FUNCTIONALIZED WITH POLYIMINE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2009-07-02 US disclosed