SCHEMBL18174749

SCHEMBL18174749

Cc1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccncc5)c(C)c4)c4ccccc34)cc2)cn1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.39
PIK3CA P42336 2/20 0.38
FYN P06241 1/20 0.38
LRRK2 Q5S007 3/20 0.37
KDR P35968 2/20 0.37
MAPK1 P28482 1/20 0.37
IMPDH2 P12268 2/20 0.37
MAPK14 Q16539 1/20 0.36
NTRK1 P04629 2/20 0.36
PDGFRB P09619 1/20 0.35
PDGFRA P16234 1/20 0.35
ACVR1 Q04771 1/20 0.35
MAPK10 P53779 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
WNT3A P56704 1/20 0.34

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
SCHEMBL18174693 0.92 MAPK14 (0.38) SLC2A1PIK3CAFYNLRRK2KDR
SCHEMBL18174694 0.89 SLC2A1 (0.49) SLC2A1FYNLRRK2KDRPDGFRB
SCHEMBL18174754 0.88 PIK3CA (0.40) PIK3CAKDRMAPK1IMPDH2MAPK14
SCHEMBL18174710 0.88 IMPDH2 (0.45) PIK3CAKDRMAPK1IMPDH2MAPK14
SCHEMBL18174553 0.86 LRRK2 (0.44) SLC2A1PIK3CAFYNLRRK2MAPK1
SCHEMBL18174639 0.86 PIK3CA (0.44) PIK3CALRRK2IMPDH2WNT3A
SCHEMBL18174648 0.85 GRM4 (0.41) PIK3CAKDRMAPK1
SCHEMBL15161061 0.85 PIK3CA (0.40) PIK3CALRRK2MAPK1IMPDH2PDGFRB
SCHEMBL18174626 0.84 GRM4 (0.42) SLC2A1PIK3CAFYNLRRK2MAPK1
SCHEMBL18174701 0.84 WNT3A (0.37) KDRCA12CA1CA2CA9

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