SCHEMBL25856607

SCHEMBL25856607

c1ccc(C2(c3ccccc3-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccc5ccccc5c3O4)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.30

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.30
KIF11 P52732 1/20 0.30
GPR84 Q9NQS5 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
OPRK1 P41145 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL25857716 0.95 GPR84 (0.32) GPR84
SCHEMBL25856407 0.95 GPR84 (0.32) GPR84
SCHEMBL25858736 0.93 KIF11 (0.30) KIF11
SCHEMBL25853197 0.92 KDM4E (0.35) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25858286 0.92 KDM4E (0.35) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25852814 0.90
SCHEMBL25857538 0.90 PDK2 (0.31) KIF11KDM4EMEN1LMNAMAPT
SCHEMBL25864229 0.88 PDK2 (0.30)
SCHEMBL25851736 0.88 MAOA (0.32)
SCHEMBL25850936 0.88 PDK2 (0.33) KDM4EMAPT

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-2023120714-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-06-29 WO disclosed