SCHEMBL23625555

SCHEMBL23625555

N#Cc1ccc2c3ccccc3n(-c3ccc(I)cc3)c2c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
USP14 P54578 3/20 0.37
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
G6PD P11413 2/20 0.36
TDP2 O95551 4/20 0.35
PTGER4 P35408 1/20 0.35
ENPP3 O14638 1/20 0.34
RPS6KB1 P23443 1/20 0.33
GSK3B P49841 1/20 0.33

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
SCHEMBL23625505 0.91 KDM4E (0.44) KDM4EATML3MBTL1USP14CA1
SCHEMBL16807020 0.88 KDM4E (0.60) KDM4EATML3MBTL1USP14CA1
SCHEMBL23625504 0.85 L3MBTL1 (0.44) KDM4EATML3MBTL1USP14TDP2
SCHEMBL17032719 0.85 KDM4E (0.43) KDM4EATML3MBTL1USP14CA1
SCHEMBL18347412 0.84 KDM4E (0.50) KDM4EATML3MBTL1USP14CA1
SCHEMBL20251562 0.84 KDM4E (0.51) KDM4EATML3MBTL1USP14CA1
SCHEMBL20251554 0.84 KDM4E (0.51) KDM4EATML3MBTL1USP14CA1
SCHEMBL17032720 0.83 KDM4E (0.42) KDM4EATML3MBTL1USP14CA1
SCHEMBL22624275 0.83 KDM4E (0.52) KDM4EATML3MBTL1USP14CA1
SCHEMBL18435977 0.82 L3MBTL1 (0.55) KDM4EATML3MBTL1GSK3B

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-2021135516-A1 ORGANIC COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC APPARATUS 陕西莱特光电材料股份有限公司 2021-07-08 WO disclosed