SCHEMBL20444739

SCHEMBL20444739

CC1(C)c2ccccc2N(c2cccc3cccc(Br)c23)c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.40
▸ KDM4E B2RXH2 8/20 0.40
▸ ALDH1A1 P00352 7/20 0.40
▸ GAA P10253 6/20 0.40
▸ HPGD P15428 3/20 0.40
▸ NSD2 O96028 1/20 0.40
▸ APP P05067 1/20 0.40
▸ SNCA P37840 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ KMT2A Q03164 9/20 0.38
▸ MEN1 O00255 8/20 0.38
▸ MAPK1 P28482 3/20 0.38
▸ LMNA P02545 4/20 0.38
▸ HTT P42858 3/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ THRB P10828 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ NPSR1 Q6W5P4 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
SCHEMBL19900161 0.83 MGLL (0.47) MAPTKDM4EALDH1A1GAAKMT2A
SCHEMBL29988767 0.83 MGLL (0.47) MAPTKDM4EALDH1A1GAAKMT2A
SCHEMBL20444565 0.81 PDE6D (0.33) MAPTKDM4EALDH1A1GAAHPGD
SCHEMBL20444549 0.81 PDE6D (0.35) MAPTKDM4EALDH1A1GAAHPGD
SCHEMBL17954513 0.77 MAPT (0.37) MAPTKDM4EALDH1A1GAAHPGD
SCHEMBL17954479 0.77 MAPT (0.37) MAPTKDM4EALDH1A1GAAHPGD
SCHEMBL20424965 0.77 KMT2A (0.42) MAPTKDM4EALDH1A1GAAHPGD
SCHEMBL20424618 0.77 KDM4E (0.42) MAPTKDM4EALDH1A1GAAHPGD
SCHEMBL22628196 0.77 PGR (0.38) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL29843848 0.77 KMT2A (0.42) MAPTKDM4EALDH1A1GAAHPGD

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-3573985-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-01-18 — — EP disclosed
WO-2018138306-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-08-02 — — WO disclosed
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