SCHEMBL4254515

SCHEMBL4254515

C(=NCCN=Cc1cc2ccccc2nn1)c1cc2ccccc2nn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 4/20 0.39
HPGD P15428 3/20 0.39
MAPT P10636 2/20 0.39
GLA P06280 1/20 0.39
ACHE P22303 1/20 0.39
RAB9A P51151 3/20 0.36
NPC1 O15118 2/20 0.36
CYP1A2 P05177 3/20 0.36
PRKAG1 P54619 1/20 0.36
PRKAA1 Q13131 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PRKAB1 Q9Y478 1/20 0.36
CA12 O43570 1/20 0.35
CA2 P00918 1/20 0.35
PDGFRB P09619 1/20 0.35
PDGFRA P16234 1/20 0.35
NQO2 P16083 1/20 0.33
KMT2A Q03164 2/20 0.33
GPR3 P46089 1/20 0.31

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
SCHEMBL4254514 1.00 KDM4E (0.41) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL4254489 0.74 NPC1 (0.65) KDM4EALDH1A1HPGDMAPTRAB9A
SCHEMBL4254487 0.74 NPC1 (0.65) KDM4EALDH1A1HPGDMAPTRAB9A
SCHEMBL291341 0.73 KDM4E (0.50) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL379404 0.73 KDM4E (0.46) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL29953056 0.73 KDM4E (0.46) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL5434515 0.73 KDM4E (0.46) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL4258810 0.72 L3MBTL1 (0.43) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL4258791 0.72 L3MBTL1 (0.43) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL4258797 0.72 L3MBTL1 (0.43) KDM4EALDH1A1HPGDMAPTGLA

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