SCHEMBL11033784

SCHEMBL11033784

CCOc1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.77
RAB9A P51151 2/20 0.55
MAPT P10636 2/20 0.55
KMT2A Q03164 2/20 0.55
NPC1 O15118 1/20 0.55
ESR1 P03372 2/20 0.54
AHR P35869 1/20 0.54
CYP1A2 P05177 2/20 0.53
CYP3A4 P08684 1/20 0.53
THPO P40225 1/20 0.53
HIF1A Q16665 1/20 0.53
MTOR P42345 1/20 0.53
LTA4H P09960 1/20 0.52
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 2/20 0.51
GMNN O75496 1/20 0.51
LMNA P02545 1/20 0.51
BLM P54132 1/20 0.51
PMP22 Q01453 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL10866111 1.00 RELA (0.77) RELARAB9AMAPTKMT2ANPC1
SCHEMBL16604897 0.90 RELA (0.72) RELARAB9AMAPTKMT2ANPC1
SCHEMBL8944052 0.89 LTA4H (0.63) RELARAB9AMAPTKMT2ANPC1
SCHEMBL6306948 0.89 LTA4H (0.63) RELARAB9AMAPTKMT2ANPC1
SCHEMBL5496245 0.87 RELA (1.00) RELARAB9AMAPTKMT2ANPC1
SCHEMBL436231 0.87 RELA (1.00) RELARAB9AMAPTKMT2ANPC1
SCHEMBL6305242 0.87 RELA (0.57) RELARAB9AMAPTKMT2ANPC1
SCHEMBL14665948 0.86 RELA (0.61) RELARAB9AMAPTKMT2ANPC1
SCHEMBL12376972 0.86 RELA (0.61) RELARAB9AMAPTKMT2ANPC1
SCHEMBL10106017 0.86 RELA (0.61) RELARAB9AMAPTKMT2ANPC1

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
JP-59067251-A None JP disclosed
JP-S5967251-A STILBENE DERIVATIVE AND ITS PREPARATION RICOH CO LTD 1984-04-16 JP disclosed