SCHEMBL23057475

SCHEMBL23057475

c1ccc(-c2ccccc2Nc2ccc(C34CC5CC(CC(C5)C3)C4)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ EPHX2 P34913 7/20 0.48
▸ SIGMAR1 Q99720 1/20 0.47
▸ NPC1 O15118 1/20 0.44
▸ LMNA P02545 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ HIF1A Q16665 1/20 0.40
▸ EPAS1 Q99814 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ FABP3 P05413 1/20 0.38
▸ FABP4 P15090 1/20 0.38
▸ FABP5 Q01469 1/20 0.38
▸ GRIN2D O15399 1/20 0.38
▸ GRIN3B O60391 1/20 0.38
▸ GRIN1 Q05586 1/20 0.38
▸ GRIN2A Q12879 1/20 0.38
▸ GRIN2B Q13224 1/20 0.38

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
SCHEMBL22161661 0.83 EPHX2 (0.53) MEN1KMT2AEPHX2NPC1LMNA
SCHEMBL21670815 0.83 EPHX2 (0.53) MEN1KMT2AEPHX2NPC1LMNA
SCHEMBL25502815 0.82 MEN1 (0.44) MEN1KMT2ANPSR1EPHX2SIGMAR1
SCHEMBL25502777 0.82 MEN1 (0.44) MEN1KMT2ANPSR1EPHX2SIGMAR1
SCHEMBL22815320 0.81 EPHX2 (0.57) MEN1KMT2AEPHX2NPC1LMNA
SCHEMBL23600757 0.81 EPHX2 (0.40) MEN1KMT2ANPSR1EPHX2SIGMAR1
SCHEMBL23600770 0.81 EPHX2 (0.40) MEN1KMT2ANPSR1EPHX2SIGMAR1
SCHEMBL24421748 0.80 EPHX2 (0.53) MEN1KMT2AEPHX2NPC1LMNA
SCHEMBL23057460 0.78 EPHX2 (0.48) MEN1KMT2AEPHX2NPC1LMNA
SCHEMBL22453102 0.78 EPHX2 (0.49) MEN1KMT2AEPHX2SIGMAR1NPC1

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
WO-2021036851-A1 NITROGEN-CONTAINING COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND PHOTOELECTRIC CONVERSION DEVICE 陕西莱特光电材料股份有限公司 2021-03-04 — — WO disclosed
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