SCHEMBL23544138

SCHEMBL23544138

C/C=C\C(=C/C)n1c2ccccc2c2cc(-c3ccc4c(c3)c3c(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cccc3n4-c3ccccc3)ccc21

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ TSPO P30536 2/20 0.33
▸ PTGER4 P35408 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ AKR1C4 P17516 1/20 0.31
▸ AKR1C3 P42330 1/20 0.31
▸ AKR1C2 P52895 1/20 0.31
▸ AKR1C1 Q04828 1/20 0.31
▸ HDAC4 P56524 1/20 0.31
▸ RXRA P19793 1/20 0.30
▸ RXRB P28702 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
SCHEMBL23544139 0.92 KDM4E (0.33) KDM4EATML3MBTL1TSPOPTGER4
SCHEMBL22198492 0.86 L3MBTL1 (0.49) KDM4EATML3MBTL1TSPOPTGER4
SCHEMBL24573688 0.84 L3MBTL1 (0.49) KDM4EATML3MBTL1TSPOPTGER4
SCHEMBL22198506 0.84 L3MBTL1 (0.49) KDM4EATML3MBTL1TSPOPTGER4
SCHEMBL18963101 0.83 L3MBTL1 (0.43) KDM4EATML3MBTL1TSPOPTGER4
SCHEMBL18563936 0.83 KDM4E (0.43) KDM4EATML3MBTL1TSPORXRA
SCHEMBL20633772 0.83 KDM4E (0.45) KDM4EATML3MBTL1TSPOPTGER4
SCHEMBL16665901 0.83 L3MBTL1 (0.47) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL16665899 0.83 L3MBTL1 (0.47) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL21928051 0.81 L3MBTL1 (0.49) KDM4EATML3MBTL1TSPOPTGER4

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
EP-3649213-B1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2021-06-23 — — EP disclosed
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