SCHEMBL22876537

SCHEMBL22876537

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5sc6ccc(-c7ccc8c(ccc9ccccc98)c7)cc6c45)cc3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F9 P00740 3/20 0.39
HSD17B1 P14061 1/20 0.38
HSD17B2 P37059 1/20 0.38
MAPT P10636 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
MAPK1 P28482 2/20 0.36
HSD17B10 Q99714 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
ATM Q13315 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL22876536 0.95 F9 (0.35) F9HSD17B1HSD17B2MAPTSMN1; SMN2
SCHEMBL25730590 0.95 F9 (0.36) F9HSD17B1HSD17B2MAPTSMN1; SMN2
SCHEMBL22876525 0.95 F9 (0.38) F9MAPTSMN1; SMN2ALDH1A1HPGD
SCHEMBL22876414 0.93 ALDH1A1 (0.37) F9HSD17B1HSD17B2MAPTSMN1; SMN2
SCHEMBL25730541 0.93 F9 (0.35) F9HSD17B1HSD17B2MAPTSMN1; SMN2
SCHEMBL22876417 0.91 MAPT (0.36) F9MAPTSMN1; SMN2ALDH1A1HPGD
SCHEMBL20391967 0.90 F9 (0.39) F9HSD17B1HSD17B2MAPTSMN1; SMN2
SCHEMBL21149244 0.90 F9 (0.36) F9HSD17B1HSD17B2MAPTSMN1; SMN2
SCHEMBL22876584 0.90 F9 (0.33) F9HSD17B1HSD17B2MAPTSMN1; SMN2
SCHEMBL22876528 0.89 CYP11B1 (0.38) F9HSD17B1HSD17B2MAPTSMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11685859-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-06-27 US disclosed
US-11685859-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-06-27 US disclosed
US-20210009894-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2021-01-14 US disclosed