SCHEMBL18174701

SCHEMBL18174701

Cc1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccccn5)c(C)c4)c4ccccc34)cc2)cn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 3/20 0.37
KDR P35968 1/20 0.37
TGFBR1 P36897 2/20 0.36
NPC1 O15118 2/20 0.35
KDM4E B2RXH2 1/20 0.35
DCTPP1 Q9H773 1/20 0.35
BRD4 O60885 1/20 0.35
BTK Q06187 1/20 0.34
CYP2A6 P11509 1/20 0.34
GRM5 P41594 1/20 0.34
RAB9A P51151 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
METAP2 P50579 1/20 0.33
METAP1 P53582 1/20 0.33
CBFB Q13951 1/20 0.33

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
SCHEMBL18174708 0.91 WNT3A (0.39) WNT3AKDRNPC1KDM4EDCTPP1
SCHEMBL15160917 0.89 CYP2A6 (0.49) KDRNPC1DCTPP1CYP2A6GRM5
SCHEMBL15160964 0.88 NPC1 (0.44) TGFBR1NPC1KDM4EDCTPP1BRD4
SCHEMBL15161038 0.86 IMPDH2 (0.38) WNT3ATGFBR1NPC1KDM4EDCTPP1
SCHEMBL18174690 0.85 CYP2A6 (0.44) WNT3AKDRNPC1KDM4ECYP2A6
SCHEMBL18174673 0.85 WNT3A (0.44) WNT3ATGFBR1NPC1KDM4E
SCHEMBL15161074 0.85 CYP2A6 (0.42) WNT3AKDRTGFBR1CYP2A6GRM5
SCHEMBL15161037 0.84 DHODH (0.46) TGFBR1NPC1KDM4EDCTPP1BRD4
SCHEMBL18174749 0.84 SLC2A1 (0.39) WNT3AKDRCA12CA1CA2
SCHEMBL18174702 0.83 RAF1 (0.36) KDRTGFBR1NPC1KDM4EDCTPP1

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