SCHEMBL4254675

SCHEMBL4254675

C(=NCCN=Cc1ccccn1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.53
NR4A1 P22736 1/20 0.50
G6PC1 P35575 1/20 0.49
USP2 O75604 1/20 0.49
MEN1 O00255 3/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
KMT2A Q03164 3/20 0.47
ATM Q13315 1/20 0.47
ALDH1A1 P00352 3/20 0.45
CA2 P00918 1/20 0.45
PKM P14618 1/20 0.45
ADORA2A P29274 1/20 0.43
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GFER P55789 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAOB P27338 1/20 0.41
MAPT P10636 1/20 0.40
HTT P42858 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
SCHEMBL4255814 1.00 MAOA (0.53) MAOANR4A1G6PC1USP2MEN1
SCHEMBL4250235 0.91 NR4A1 (0.59) MAOANR4A1G6PC1USP2MEN1
SCHEMBL4250239 0.91 NR4A1 (0.59) MAOANR4A1G6PC1USP2MEN1
SCHEMBL4255942 0.89 G6PC1 (0.47) MAOANR4A1G6PC1USP2MEN1
SCHEMBL4252465 0.89 G6PC1 (0.47) MAOANR4A1G6PC1USP2MEN1
SCHEMBL8719353 0.83 NR4A1 (0.55) MAOANR4A1G6PC1USP2MEN1
SCHEMBL12714965 0.83 NR4A1 (0.55) MAOANR4A1G6PC1USP2MEN1
SCHEMBL12470494 0.81 G6PC1 (0.55) MAOANR4A1G6PC1USP2MEN1
SCHEMBL4256710 0.80 CA2 (0.61) G6PC1MEN1KMT2AALDH1A1CA2
SCHEMBL845363 0.80 CA2 (0.61) G6PC1MEN1KMT2AALDH1A1CA2

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