SCHEMBL23028795

SCHEMBL23028795

c1ccc(C23c4ccccc4Oc4cc(-c5ccncc5)cc(c42)Oc2ccccc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.41
BACE1 P56817 4/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
ATAD2 Q6PL18 1/20 0.34
PDK2 Q15119 2/20 0.34
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CTSD P07339 1/20 0.32
BACE2 Q9Y5Z0 1/20 0.32
KDR P35968 1/20 0.32
PRKCI P41743 1/20 0.32
KIF11 P52732 1/20 0.32
KCNH2 Q12809 1/20 0.32
IKBKB O14920 1/20 0.31

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
SCHEMBL23028844 0.89 LMNA (0.33) BACE1MAPTLMNAHSD17B10
SCHEMBL17482795 0.82 NOTUM (0.46) NOTUMBACE1NPC1RAB9AATAD2
SCHEMBL23028801 0.79 L3MBTL1 (0.37) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL23028855 0.78 BACE1 (0.36) BACE1PDK2MAPTLMNAHSD17B10
SCHEMBL23028838 0.78 LMNA (0.39) MAPTLMNASMN1; SMN2
SCHEMBL23028796 0.78 TNF (0.42) BACE1LMNAKDRIKBKE
SCHEMBL23028798 0.78 CYP19A1 (0.56) BACE1NPC1RAB9APDK2LMNA
SCHEMBL4388225 0.76 ALOX5 (0.41) MAPTLMNASMN1; SMN2
SCHEMBL23028845 0.76 GPR84 (0.32) SMN1; SMN2
SCHEMBL23028785 0.76 AHR (0.40) MAPTLMNAKIF11

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-2021034089-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-02-25 WO disclosed