Sugi Predict

Sugi Predict / Compounds / SCHEMBL25843166

SCHEMBL25843166

SCHEMBL25843166

CC1(C)c2ccccc2-c2cc(-c3ccc4c5c(cccc35)-c3ccccc3O4)ccc21

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ MEN1 O00255 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ MAOA P21397 1/20 0.30
▸ MAOB P27338 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
SCHEMBL25843054 0.94 KDM4E (0.41) KDM4EMAPK1ATMMEN1POLB
SCHEMBL25842611 0.90 KDM4E (0.42) KDM4EMAPK1ATMMEN1POLB
SCHEMBL23109669 0.90 KDM4E (0.38) KDM4EMAPK1ATM
SCHEMBL25868886 0.89 KDM4E (0.39) KDM4EMAPK1ATMMEN1POLB
SCHEMBL25868553 0.89 KDM4E (0.39) KDM4EMAPK1ATMMEN1POLB
SCHEMBL25842724 0.89 KDM4E (0.37) KDM4EMAPK1ATM
SCHEMBL19600422 0.88 KDM4E (0.37) KDM4EMAPK1ATMMEN1POLB
SCHEMBL25859512 0.87 MAPK1 (0.43) KDM4EMAPK1ATMMAOAMAOB
SCHEMBL25875589 0.87 PDK2 (0.37) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL18021834 0.86 KDM4E (0.33) KDM4EMAPK1ATM

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