SCHEMBL12912968

SCHEMBL12912968

Cc1ccc2c(c1)/C(c1ccccc1)=N\c1ccc(C)cc1/C(c1ccccc1)=N\2

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.58
RAB9A P51151 4/20 0.58
NPC1 O15118 3/20 0.58
LMNA P02545 2/20 0.48
IDO1 P14902 1/20 0.47
CHRM1 P11229 2/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
PKM P14618 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
GSK3A P49840 1/20 0.43
GSK3B P49841 1/20 0.43
CDK5 Q00535 1/20 0.43
CDK5R1 Q15078 1/20 0.43
PSMB5 P28074 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
HDAC7 Q8WUI4 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
SCHEMBL14455169 0.87 MAPT (0.52) MAPTRAB9ANPC1LMNACHRM1
SCHEMBL31106542 0.86 CDK5 (0.58) MAPTRAB9ANPC1LMNAIDO1
SCHEMBL19107709 0.82 CHRM1 (0.53) MAPTRAB9ANPC1LMNAIDO1
SCHEMBL12316864 0.81 MAPT (0.87) MAPTRAB9ANPC1LMNASMN1; SMN2
SCHEMBL10470932 0.80 CHRM1 (0.51) MAPTRAB9ANPC1LMNAIDO1
SCHEMBL28253943 0.77 MAPT (0.43) MAPTRAB9ANPC1LMNAIDO1
SCHEMBL11653909 0.76 CHRM1 (0.48) MAPTRAB9ANPC1LMNAIDO1
SCHEMBL29706122 0.76 RXRA (0.48) MAPTRAB9ANPC1LMNAIDO1
SCHEMBL29706181 0.76 RARB (0.48) MAPTRAB9ANPC1IDO1SMN1; SMN2
SCHEMBL12912867 0.76 IDO1 (0.50) MAPTRAB9ANPC1LMNAIDO1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420750-B2 Copolymers of dibendiazocine with difunctional monomers containing sulfone and/or ketone units SOLVAY ADVANCED POLYMERS, L.L.C. (US) 2013-04-16 US disclosed
US-20110009563-A1 Copolymers of dibendiazocine with difunctional monomers containing sulfone and/or ketone units SOLVAY ADVANCED POLYMERS, L.L.C. (US) 2011-01-13 US disclosed
US-7238771-B2 Dibenzodiazocine polymers SOLVAY ADVANCED POLYMERS, L.L.C. (US) 2007-07-03 US disclosed