SCHEMBL24765853

SCHEMBL24765853

c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccc7ccccc7c5n6-c5cccc6sc7ccccc7c56)ccc43)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ TSPO P30536 1/20 0.30
▸ CYP1A1 P04798 1/20 0.30
▸ CYP1B1 Q16678 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
SCHEMBL24765758 0.97 TSPO (0.30) TSPO
SCHEMBL24765836 0.95 KDM4E (0.33) KDM4EATML3MBTL1TSPOCYP1A1
SCHEMBL24766156 0.95 KDM4E (0.32) KDM4EATML3MBTL1CYP1A1CYP1B1
SCHEMBL24765842 0.95 KDM4E (0.38) KDM4EATML3MBTL1
SCHEMBL24765789 0.94 PDE6D (0.31) —
SCHEMBL24766160 0.94 KDM4E (0.33) KDM4EATML3MBTL1CYP1A1CYP1B1
SCHEMBL24765752 0.92 PDE6D (0.32) KDM4EATML3MBTL1TSPOCYP1A1
SCHEMBL24765761 0.92 KDM4E (0.34) KDM4EATML3MBTL1
SCHEMBL24766153 0.92 CYP1A1 (0.31) CYP1A1CYP1B1
SCHEMBL24766163 0.91 — —

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-2022260443-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2022-12-15 — — WO disclosed
Send feedback