SCHEMBL25965998

SCHEMBL25965998

CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ccc(-c2nc(-c3ccc(-c4ccccc4)cc3)nc(-n3c4ccccc4c4ccccc43)n2)cc1

nearest known ligand 0.39

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
▸ HDAC4 P56524 1/20 0.32
▸ RXRA P19793 1/20 0.30
▸ RORC P51449 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
SCHEMBL25966366 0.99 KDM4E (0.33) KDM4EATML3MBTL1HDAC4RXRA
SCHEMBL24078128 0.96 KDM4E (0.33) KDM4EATML3MBTL1HDAC4RXRA
SCHEMBL19104585 0.95 GSK3B (0.30) L3MBTL1
SCHEMBL31845 0.95 L3MBTL1 (0.33) KDM4EATML3MBTL1HDAC4RXRA
SCHEMBL24078146 0.94 — —
SCHEMBL26011852 0.94 PDK2 (0.30) —
SCHEMBL24078205 0.93 KDM4E (0.31) KDM4EATML3MBTL1
SCHEMBL16406774 0.93 PTGER4 (0.35) KDM4EATML3MBTL1
SCHEMBL25965995 0.93 KDM4E (0.31) KDM4EATML3MBTL1
SCHEMBL18564381 0.93 KDM4E (0.32) KDM4EATML3MBTL1RORC

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
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