SCHEMBL22876596

SCHEMBL22876596

c1ccc(-c2nc(-c3cccc(-c4cccc5sc6ccc(-c7ccc8ccc9c%10ccccc%10ccc9c8c7)cc6c45)c3)nc(-c3ccc4sc5ccccc5c4c3)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F9 P00740 2/20 0.34
ALOX5 P09917 1/20 0.34
PIM3 Q86V86 1/20 0.34
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
MAPK1 P28482 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
ATM Q13315 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LIMK1 P53667 2/20 0.32
CYP1A1 P04798 1/20 0.32

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
SCHEMBL22876417 0.96 MAPT (0.36) F9ALOX5PIM3MAPTSMN1; SMN2
SCHEMBL22876536 0.94 F9 (0.35) F9ALOX5PIM3MAPTSMN1; SMN2
SCHEMBL22876318 0.93 ALOX5 (0.36) F9ALOX5PIM3MAPTSMN1; SMN2
SCHEMBL22876503 0.92 F9 (0.36) F9ALOX5MAPTSMN1; SMN2KDM4E
SCHEMBL22876626 0.91 CYP11B1 (0.36) F9ALOX5PIM3MAPTSMN1; SMN2
SCHEMBL22876283 0.91 PIM3 (0.39) F9ALOX5PIM3MAPTSMN1; SMN2
SCHEMBL22876525 0.91 F9 (0.38) F9ALOX5PIM3MAPTSMN1; SMN2
SCHEMBL20391968 0.91 LIMK1 (0.36) F9ALOX5PIM3MAPTSMN1; SMN2
SCHEMBL19803059 0.91 F9 (0.33) F9ALOX5PIM3MAPTSMN1; SMN2
SCHEMBL22876304 0.90 ALOX5 (0.36) F9ALOX5PIM3MAPTSMN1; 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