SCHEMBL25966464

SCHEMBL25966464

CC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ PTGER4 P35408 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ HDAC4 P56524 1/20 0.31
▸ RXRA P19793 1/20 0.30
▸ PDE10A Q9Y233 1/20 0.30
▸ RAC2 P15153 1/20 0.30
▸ RAC3 P60763 1/20 0.30
▸ CDC42 P60953 1/20 0.30
▸ RAC1 P63000 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
SCHEMBL25966563 0.99 KDM4E (0.35) KDM4EATML3MBTL1PTGER4RXFP1
SCHEMBL18564321 0.99 KDM4E (0.34) KDM4EATML3MBTL1PTGER4RXFP1
SCHEMBL18564267 0.99 KDM4E (0.34) KDM4EATML3MBTL1PTGER4RXFP1
SCHEMBL24078191 0.97 KDM4E (0.34) KDM4EATML3MBTL1PTGER4RXFP1
SCHEMBL18505533 0.97 KDM4E (0.34) KDM4EATML3MBTL1PTGER4RXFP1
SCHEMBL25966458 0.97 KDM4E (0.35) KDM4EATML3MBTL1RXFP1PDE10A
SCHEMBL2603602 0.97 KDM4E (0.35) KDM4EATML3MBTL1RXFP1PDE10A
SCHEMBL25966394 0.96 KDM4E (0.36) KDM4EATML3MBTL1PTGER4RXFP1
SCHEMBL25966488 0.95 KDM4E (0.35) KDM4EATML3MBTL1PTGER4RXFP1
SCHEMBL18564353 0.95 KDM4E (0.34) KDM4EATML3MBTL1PTGER4RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 — — US disclosed
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 — — US disclosed
Send feedback