SCHEMBL9883286

SCHEMBL9883286

CC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cccc(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.36
▸ KMT2A Q03164 5/20 0.36
▸ MAPT P10636 4/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ HPGD P15428 3/20 0.36
▸ LMNA P02545 3/20 0.36
▸ ATM Q13315 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ GLA P06280 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.31
▸ PDE10A Q9Y233 1/20 0.31
▸ NTSR1 P30989 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ MAPK10 P53779 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ PGR P06401 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
SCHEMBL24078764 0.98 MEN1 (0.35) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL22303001 0.97 MEN1 (0.36) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL17879054 0.97 KDM4E (0.34) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL9883244 0.96 MEN1 (0.36) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL18564244 0.95 KDM4E (0.34) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL18566739 0.95 KDM4E (0.33) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL19653405 0.94 RXFP1 (0.37) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL25966115 0.94 MEN1 (0.35) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL2603602 0.94 KDM4E (0.35) KDM4EATML3MBTL1RXFP1PDE10A
SCHEMBL25966458 0.94 KDM4E (0.35) KDM4EATML3MBTL1RXFP1PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9324954-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2016-04-26 — — US disclosed
US-9324954-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2016-04-26 — — US disclosed
US-20130240796-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmnH (DE) 2013-09-19 — — US disclosed
US-20130240796-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmnH (DE) 2013-09-19 — — US disclosed
WO-2012069121-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-05-31 — — WO disclosed
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