SCHEMBL24676087

SCHEMBL24676087

c1ccc(C2(c3ccccc3)c3cc(-n4c5ccccc5c5ccccc54)ccc3-c3ccc(-n4c5ccccc5c5c6oc7ccccc7c6ccc54)cc32)cc1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX5 P09917 1/20 0.32
PTGER4 P35408 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
BRCA1 P38398 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL18086184 0.96 ALOX5 (0.33) ALOX5PTGER4MEN1ALDH1A1POLB
SCHEMBL16482229 0.94 ALOX5 (0.32) KDM4EATML3MBTL1ALOX5
SCHEMBL17109018 0.90 PTGER4 (0.31) PTGER4
SCHEMBL17299778 0.90 KDM4E (0.32) KDM4EATML3MBTL1MEN1ALDH1A1
SCHEMBL16484997 0.89 MEN1 (0.32) KDM4EATML3MBTL1MEN1ALDH1A1
SCHEMBL18086190 0.89 ALOX5 (0.36) ALOX5PTGER4MEN1ALDH1A1POLB
SCHEMBL18086186 0.89 ALOX5 (0.36) ALOX5PTGER4MEN1ALDH1A1POLB
SCHEMBL18086188 0.88 KDM4E (0.33) KDM4EATML3MBTL1ALOX5MEN1
SCHEMBL24676046 0.88 KDM4E (0.33) KDM4EATML3MBTL1ALOX5PTGER4
SCHEMBL16484296 0.87 MEN1 (0.35) KDM4EATML3MBTL1MEN1ALDH1A1

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
US-20220238815-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, COMPOUND, AND ELECTRONIC APPLIANCE IDEMITSU KOSAN CO.,LTD. (JP) 2022-07-28 US disclosed