SCHEMBL25757321

SCHEMBL25757321

C=C/C=C\c1c(C)c2ccccc2n1-c1ccc2c(c1)c1ccc(-n3c4ccccc4c4ccccc43)cc1n2-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.41
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GAA P10253 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ AKR1C4 P17516 1/20 0.30
▸ AKR1C3 P42330 1/20 0.30
▸ AKR1C2 P52895 1/20 0.30
▸ AKR1C1 Q04828 1/20 0.30
▸ GFER P55789 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
SCHEMBL25693709 0.94 KDM4E (0.42) KDM4EATML3MBTL1GAAAKR1C4
SCHEMBL20698444 0.93 KDM4E (0.45) KDM4EATML3MBTL1GAAMAPT
SCHEMBL21348639 0.90 KDM4E (0.40) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL19509854 0.89 KDM4E (0.46) KDM4EATML3MBTL1GAAMAPT
SCHEMBL18643556 0.87 KDM4E (0.41) KDM4EATML3MBTL1MAPT
SCHEMBL18436869 0.87 KDM4E (0.46) KDM4EATML3MBTL1MAPT
SCHEMBL19444806 0.86 KDM4E (0.43) KDM4EATML3MBTL1GAAMAPT
SCHEMBL20121829 0.85 KDM4E (0.42) KDM4EATML3MBTL1
SCHEMBL12909044 0.84 KDM4E (0.41) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL13709331 0.84 KDM4E (0.40) KDM4EATML3MBTL1

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-4206301-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL Chemical & Material Co., Ltd. (JP) 2023-07-05 — — EP disclosed
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