SCHEMBL20125567

SCHEMBL20125567

Cc1nc(-c2ccccc2)cc(-c2ccccc2)c1C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SQOR Q9Y6N5 2/20 0.62
KMT2A Q03164 6/20 0.53
ALDH1A1 P00352 6/20 0.53
MEN1 O00255 5/20 0.53
KDM4E B2RXH2 5/20 0.53
MAPT P10636 4/20 0.53
POLB P06746 1/20 0.53
PKM P14618 1/20 0.53
RAB9A P51151 1/20 0.53
ADORA2A P29274 4/20 0.50
ADORA1 P30542 4/20 0.50
ADORA3 P0DMS8 1/20 0.50
HPGD P15428 4/20 0.47
NPSR1 Q6W5P4 3/20 0.47
PPARG P37231 1/20 0.47
NCOA2 Q15596 1/20 0.47
NCOA1 Q15788 1/20 0.47
NCOA3 Q9Y6Q9 1/20 0.47
L3MBTL1 Q9Y468 4/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL10199342 0.83 ALDH1A1 (0.53) SQORKMT2AALDH1A1MEN1KDM4E
SCHEMBL13299548 0.83 ALDH1A1 (0.69) SQORKMT2AALDH1A1MEN1KDM4E
SCHEMBL10205853 0.82 SQOR (0.51) SQORKMT2AALDH1A1MEN1KDM4E
SCHEMBL10205860 0.82 MEN1 (0.72) SQORKMT2AALDH1A1MEN1KDM4E
SCHEMBL12620536 0.80 ADORA1 (0.58) SQORKMT2AALDH1A1MEN1KDM4E
SCHEMBL11937166 0.80 ADORA1 (0.71) SQORKMT2AALDH1A1MEN1KDM4E
SCHEMBL29442453 0.77 SQOR (1.00) SQORKMT2AALDH1A1MEN1KDM4E
SCHEMBL22208261 0.77 SQOR (1.00) SQORKMT2AALDH1A1MEN1KDM4E
SCHEMBL2189712 0.77 ALDH1A1 (0.56) SQORKMT2AALDH1A1MEN1KDM4E
SCHEMBL10205918 0.77 SMARCA2 (0.59) SQORKMT2AALDH1A1MEN1KDM4E

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-2675867-B1 MATERIAL FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE CHEIL IND INC (KR) 2018-05-09 EP disclosed