SCHEMBL25147252

SCHEMBL25147252

c1ccc(-c2nc(-n3c4ccccc4c4ccccc43)nc3c2oc2cc4c(cc23)c2ccccc2n4-c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ ALDH1A1 P00352 7/20 0.32
▸ KMT2A Q03164 5/20 0.32
▸ TSHR P16473 4/20 0.32
▸ MEN1 O00255 4/20 0.32
▸ HSD17B10 Q99714 3/20 0.32
▸ POLB P06746 2/20 0.32
▸ BRCA1 P38398 1/20 0.32
▸ MAPT P10636 6/20 0.32
▸ CSF1R P07333 1/20 0.32
▸ PDGFRB P09619 1/20 0.32
▸ KIT P10721 1/20 0.32
▸ FLT3 P36888 1/20 0.32
▸ HDAC6 Q9UBN7 1/20 0.32
▸ IL1R1 P14778 1/20 0.31
▸ HPGD P15428 3/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31

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
SCHEMBL26741226 0.94 KDM4E (0.37) KDM4EL3MBTL1ATMALDH1A1KMT2A
SCHEMBL26741225 0.93 KDM4E (0.38) KDM4EL3MBTL1ATMALDH1A1KMT2A
SCHEMBL19246888 0.92 KDM4E (0.39) KDM4EL3MBTL1ATMALDH1A1KMT2A
SCHEMBL26741467 0.92 KDM4E (0.35) KDM4EL3MBTL1ATM
SCHEMBL19246954 0.91 KDM4E (0.40) KDM4EL3MBTL1ATMALDH1A1KMT2A
SCHEMBL25146875 0.90 KDM4E (0.41) KDM4EL3MBTL1ATMALDH1A1KMT2A
SCHEMBL20029924 0.89 KDM4E (0.38) KDM4EL3MBTL1ATMALDH1A1KMT2A
SCHEMBL20030085 0.89 KDM4E (0.38) KDM4EL3MBTL1ATMALDH1A1KMT2A
SCHEMBL18852892 0.89 KDM4E (0.36) KDM4EL3MBTL1ATMTSHR
SCHEMBL25146805 0.88 KDM4E (0.39) KDM4EL3MBTL1ATMALDH1A1KMT2A

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-2023061998-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-04-20 — — WO disclosed
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