SCHEMBL26157693

SCHEMBL26157693

CC(C)(C)c1ccc(-c2ccccc2Nc2cccc(-c3ccc(-c4ccccc4)c4ccccc34)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK18 Q7Z418 1/20 0.44
ABCG2 Q9UNQ0 6/20 0.43
CCR4 P51679 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
RECQL P46063 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CNR1 P21554 1/20 0.38
KCNK9 Q9NPC2 1/20 0.38
CDC25B P30305 2/20 0.38
ABCB1 P08183 3/20 0.38
ABCC1 P33527 2/20 0.38
GPR84 Q9NQS5 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.37
SIRT1 Q96EB6 1/20 0.37
SYK P43405 1/20 0.37

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
SCHEMBL24958544 0.87 MEN1 (0.50) ABCG2KDM4EMEN1GLAGAA
SCHEMBL26157671 0.87 SIRT2 (0.39) KCNK18ABCG2KDM4EMEN1GLA
SCHEMBL26157619 0.87 KCNK18 (0.39) KCNK18ABCG2KDM4EMEN1GLA
SCHEMBL26157814 0.85 FABP3 (0.43) ABCG2CCR4MEN1KMT2ACDC25B
SCHEMBL25450282 0.84 KCNK18 (0.44) KCNK18ABCG2CCR4KDM4EMEN1
SCHEMBL31019421 0.83 KCNK18 (0.60) KCNK18ABCG2GAAMAPTSIRT2
SCHEMBL24504902 0.83 KCNK18 (0.60) KCNK18ABCG2GAAMAPTSIRT2
SCHEMBL26157646 0.82 MEN1 (0.44) ABCG2KDM4EMEN1GLAGAA
SCHEMBL21226201 0.81 ABCG2 (0.48) KCNK18ABCG2MAPTTACR1
SCHEMBL29407530 0.81 ABCG2 (0.48) KCNK18ABCG2MAPTTACR1

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-2023096210-A1 COMPOUND FOR ORGANIC ELECTRICAL ELEMENT, ORGANIC ELECTRICAL ELEMENT USING SAME AND ELECTRONIC DEVICE THEREFOR 덕산네오룩스 주식회사 2023-06-01 WO disclosed