SCHEMBL25859732

SCHEMBL25859732

CC1(C)c2cc(-c3ccc4cccc5c4c3Oc3ccccc3-5)ccc2-c2ccc3ccccc3c21

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
ENPP3 O14638 1/20 0.33
ENPP1 P22413 1/20 0.33
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL25860555 0.91 KDM4E (0.40) KDM4EMAPK1ATMENPP3ENPP1
SCHEMBL25859734 0.88 KDM4E (0.39) KDM4EMAPK1ATMENPP3ENPP1
SCHEMBL25859643 0.87 KDM4E (0.40) KDM4EMAPK1ATMENPP3ENPP1
SCHEMBL25844068 0.87 KDM4E (0.40) KDM4EMAPK1ATMENPP3ENPP1
SCHEMBL25859733 0.86 MAPK1 (0.41) KDM4EMAPK1ATM
SCHEMBL25860854 0.85 KDM4E (0.47) KDM4EMAPK1ATMENPP3ENPP1
SCHEMBL25867213 0.85 ENPP3 (0.33) KDM4EENPP3ENPP1MEN1KMT2A
SCHEMBL25859647 0.85 KDM4E (0.38) KDM4EMAPK1ATM
SCHEMBL25860066 0.84 KDM4E (0.46) KDM4EMAPK1ATMENPP3ENPP1
SCHEMBL25863169 0.84 KDM4E (0.40) KDM4EMAPK1ATMENPP3ENPP1

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