SCHEMBL28453044

SCHEMBL28453044

Cc1ccc(-c2cc(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.56
MEN1 O00255 6/20 0.56
KMT2A Q03164 6/20 0.56
ALDH1A1 P00352 6/20 0.56
MAPT P10636 5/20 0.56
HPGD P15428 3/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
POLB P06746 3/20 0.53
RAB9A P51151 3/20 0.53
PKM P14618 1/20 0.53
AGTR1 P30556 1/20 0.51
PPARG P37231 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
NCOA2 Q15596 1/20 0.51
NCOA1 Q15788 1/20 0.51
NCOA3 Q9Y6Q9 1/20 0.51
ADORA2A P29274 1/20 0.51
ADORA1 P30542 1/20 0.51
MCL1 Q07820 1/20 0.49

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
SCHEMBL13203110 0.91 MEN1 (0.52) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL13203307 0.90 MEN1 (0.50) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL28026305 0.89 MEN1 (0.53) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL28446763 0.85 ADORA1 (0.49) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL29724212 0.85 ADORA1 (0.49) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL28446307 0.83 AGTR1 (0.51) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL28452051 0.83 MEN1 (0.59) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL28449039 0.83 L3MBTL1 (0.51) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL28457021 0.83 ACACA (0.62) KDM4EKMT2AALDH1A1MAPTHPGD
SCHEMBL13203040 0.82 MEN1 (0.50) KDM4EMEN1KMT2AALDH1A1MAPT

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
CN-111499565-B Preparation method of 2,3,4, 6-tetra-substituted pyridine compound 台州学院 2022-04-26 CN disclosed
CN-111499565-A Preparation method of 2,3,4, 6-tetra-substituted pyridine compound 台州学院 2020-08-07 CN disclosed