SCHEMBL23468698

SCHEMBL23468698

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5oc6cc(-n7c8cc9ccccc9cc8c8cc9ccccc9cc87)ccc6c45)n3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.32
PTGER4 P35408 1/20 0.31
KDM4E B2RXH2 2/20 0.31
MAPT P10636 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
MAPK1 P28482 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
ATM Q13315 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL23204158 0.98 PTGER4 (0.32) PTGER4KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL21862715 0.96
SCHEMBL26415822 0.96 PTGER4 (0.31) PTGER4KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL21863023 0.96 PTGER4 (0.31) PTGER4KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL24223612 0.96 ALDH1A1 (0.35) PTGER4KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL23203768 0.96 PTGER4 (0.35) PTGER4KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL26416793 0.95 PDE6D (0.31) PDE6DKDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL21863024 0.94 PTGER4 (0.32) PTGER4KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL24223735 0.94 ALDH1A1 (0.37) PTGER4KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL21862741 0.93 ALDH1A1 (0.32) PTGER4KDM4EMAPTSMN1; SMN2ALDH1A1

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
EP-3832746-A1 ORGANIC LIGHT-EMITTING DEVICE LG Chem, Ltd. (KR) 2021-06-09 EP disclosed