SCHEMBL23944613

SCHEMBL23944613

COc1cc2cccnc2cc1-c1c(N)cc(Cl)cc1Br

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.52
PDGFRA P16234 2/20 0.52
CASP6 P55212 2/20 0.45
NR4A2 P43354 2/20 0.42
NSD2 O96028 1/20 0.40
G6PD P11413 1/20 0.40
TLR8 Q9NR97 1/20 0.39
PDE10A Q9Y233 1/20 0.37
P2RX3 P56373 1/20 0.36
P2RX2 Q9UBL9 1/20 0.36
AMY1A P0DUB6 1/20 0.36
HTT P42858 3/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
HSP90AA1 P07900 1/20 0.35

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
SCHEMBL23944311 0.95 PDGFRB (0.52) PDGFRBPDGFRACASP6NR4A2NSD2
SCHEMBL23944928 0.81 PDGFRB (0.55) PDGFRBPDGFRACASP6NR4A2NSD2
SCHEMBL6608733 0.77 PDGFRB (0.74) PDGFRBPDGFRACASP6NSD2TLR8
SCHEMBL23944919 0.76 PDGFRB (0.55) PDGFRBPDGFRACASP6NR4A2G6PD
SCHEMBL15876716 0.74 PDGFRB (0.74) PDGFRBPDGFRACASP6NSD2TLR8
SCHEMBL28691140 0.74 PDGFRB (0.59) PDGFRBPDGFRACASP6NSD2TLR8
SCHEMBL23947106 0.72 NSD2 (0.42) PDGFRBPDGFRACASP6NR4A2NSD2
SCHEMBL23946703 0.72 NSD2 (0.45) PDGFRBPDGFRACASP6NR4A2NSD2
SCHEMBL16346602 0.72 PDGFRB (0.74) PDGFRBPDGFRACASP6NR4A2TLR8
SCHEMBL360006 0.72 PDGFRB (0.74) PDGFRBPDGFRACASP6NSD2G6PD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021210910-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-10-21 WO disclosed