SCHEMBL21279079

SCHEMBL21279079

Cc1ccccc1-c1ccc2c(c1)c1ccccc1n2-c1cc(-c2cc(-c3ccccc3)nc(-c3ccccc3)n2)cc(-n2c3ccccc3c3cc(-c4ccccc4C)ccc32)c1C#N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SQOR Q9Y6N5 5/20 0.39
L3MBTL1 Q9Y468 4/20 0.39
ADORA2A P29274 5/20 0.39
ADORA1 P30542 5/20 0.39
KDM4E B2RXH2 4/20 0.39
HPGD P15428 4/20 0.39
NPSR1 Q6W5P4 3/20 0.39
PPARG P37231 1/20 0.39
NCOA2 Q15596 1/20 0.39
NCOA1 Q15788 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
ALDH1A1 P00352 3/20 0.38
NPC1 O15118 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 3/20 0.35
LMNA P02545 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL22563437 0.97 SQOR (0.40) SQORL3MBTL1ADORA2AADORA1KDM4E
SCHEMBL21279081 0.97 L3MBTL1 (0.41) SQORL3MBTL1ADORA2AADORA1KDM4E
SCHEMBL22563692 0.94 L3MBTL1 (0.42) SQORL3MBTL1ADORA2AADORA1KDM4E
SCHEMBL19942684 0.93 AR (0.35) SQORL3MBTL1ADORA2AADORA1KDM4E
SCHEMBL19909440 0.92 SQOR (0.40) SQORL3MBTL1ADORA2AADORA1KDM4E
SCHEMBL22562535 0.91 ADORA2A (0.39) SQORL3MBTL1ADORA2AADORA1KDM4E
SCHEMBL19942679 0.90 AR (0.37) SQORL3MBTL1ADORA2AADORA1KDM4E
SCHEMBL19909441 0.89 L3MBTL1 (0.43) SQORL3MBTL1ADORA2AADORA1KDM4E
SCHEMBL21278726 0.89 MEN1 (0.42) SQORL3MBTL1ADORA2AADORA1KDM4E
SCHEMBL21279044 0.89 SQOR (0.39) SQORL3MBTL1ADORA2AADORA1KDM4E

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
EP-3399004-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-08-21 EP disclosed