SCHEMBL18174571

SCHEMBL18174571

Cc1ccc(-c2c3ccccc3c(-c3ccc(C)c(-c4ccccn4)c3)c3ccccc23)cc1-c1ccccn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.44
KDM4E B2RXH2 2/20 0.44
BTK Q06187 1/20 0.43
BRD4 O60885 1/20 0.42
PKM P14618 2/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41
CCR1 P32246 2/20 0.41
CCR5 P51681 2/20 0.41
CCR8 P51685 2/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
POLB P06746 1/20 0.41
METAP1 P53582 1/20 0.41
BLM P54132 1/20 0.41
HIF1A Q16665 1/20 0.41

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
SCHEMBL10032909 0.92 KDM4E (0.46) NPC1KDM4EBTKBRD4PKM
SCHEMBL18174583 0.90 BTK (0.38) NPC1KDM4EBTKBRD4PKM
SCHEMBL15160964 0.87 NPC1 (0.44) NPC1KDM4EBTKBRD4PKM
SCHEMBL18174568 0.87 RET (0.44) NPC1KDM4EBTKBRD4PKM
SCHEMBL21022955 0.86 NPC1 (0.49) NPC1KDM4EBTKPKMRAB9A
SCHEMBL19882223 0.84 NPC1 (0.41) NPC1KDM4EBTKPKMRAB9A
SCHEMBL10032874 0.84 KDM4E (0.44) NPC1KDM4EPKMRAB9AMEN1
SCHEMBL18657149 0.83 NPC1 (0.46) NPC1KDM4EBTKPKMRAB9A
SCHEMBL18571558 0.82 BTK (0.49) NPC1KDM4EBTKPKMRAB9A
SCHEMBL17086997 0.81 TGFBR1 (0.46) NPC1KDM4EBTKPKMRAB9A

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
US-9478750-B2 Anthracene derivative and organic electroluminescent element using the same JNC CORPORATION (JP) 2016-10-25 US disclosed
US-9478750-B2 Anthracene derivative and organic electroluminescent element using the same JNC CORPORATION (JP) 2016-10-25 US disclosed