SCHEMBL881129

SCHEMBL881129

C1=Cc2c(c3ccccc3n2-c2ccc(Nc3ccccc3Nc3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.37
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ CDK4 P11802 2/20 0.31
▸ CDK6 Q00534 2/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ GLA P06280 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ RECQL P46063 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ TDP1 Q9NUW8 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
SCHEMBL18872780 0.89 HSP90AA1 (0.37) KDM4EATML3MBTL1MAPTTDP1
SCHEMBL14050165 0.88 KDM4E (0.47) KDM4EATML3MBTL1
SCHEMBL12557529 0.85 HSP90AA1 (0.35) KDM4EATML3MBTL1TDP1
SCHEMBL257569 0.84 KDM4E (0.43) KDM4EATML3MBTL1
SCHEMBL12018511 0.82 KDM4E (0.41) KDM4EATML3MBTL1
SCHEMBL12153423 0.82 L3MBTL1 (0.38) KDM4EATML3MBTL1MEN1MAPT
SCHEMBL13271183 0.82 KDM4E (0.42) KDM4EATML3MBTL1
SCHEMBL12939244 0.81 L3MBTL1 (0.48) KDM4EATML3MBTL1MEN1GLA
SCHEMBL14037002 0.81 KDM4E (0.40) KDM4EATML3MBTL1MAPT
SCHEMBL12963948 0.81 KDM4E (0.40) KDM4EATML3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1956008-B1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, COMPOSITION FOR CHARGE-TRANSPORTING MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE MITSUBISHI CHEM CORP (JP) 2012-03-28 — — EP disclosed
EP-1956008-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, COMPOSITION FOR CHARGE-TRANSPORTING MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE Mitsubishi Chemical Corporation (JP) 2008-08-13 — — EP disclosed
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