SCHEMBL29145178

SCHEMBL29145178

COC(=O)n1c(C)nc2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.66
ALDH1A1 P00352 4/20 0.62
KMT2A Q03164 1/20 0.62
HTT P42858 3/20 0.51
ASAH1 Q13510 1/20 0.51
CNR2 P34972 1/20 0.48
PSMD14 O00487 1/20 0.47
GAA P10253 1/20 0.47
KDM4E B2RXH2 3/20 0.47
PKM P14618 2/20 0.47
TSHR P16473 2/20 0.47
MAPK1 P28482 2/20 0.47
MAPT P10636 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
APAF1 O14727 1/20 0.46
HPGD P15428 2/20 0.45
LMNA P02545 1/20 0.45
CASP1 P29466 1/20 0.45

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
SCHEMBL133464 0.83 ALDH1A1 (0.57) L3MBTL1ALDH1A1KMT2AHTTASAH1
SCHEMBL29145160 0.83 L3MBTL1 (0.61) L3MBTL1ALDH1A1KMT2ACNR2KDM4E
SCHEMBL29145079 0.82 L3MBTL1 (0.64) L3MBTL1ALDH1A1KMT2AASAH1CNR2
SCHEMBL11702245 0.82 L3MBTL1 (0.64) L3MBTL1KMT2AHTTASAH1KDM4E
SCHEMBL29145095 0.82 L3MBTL1 (0.64) L3MBTL1ALDH1A1KMT2AASAH1CNR2
SCHEMBL822015 0.81 ALDH1A1 (0.68) L3MBTL1ALDH1A1KMT2AHTTASAH1
SCHEMBL27945131 0.81 KMT2A (0.68) ALDH1A1KMT2AHTTASAH1GAA
SCHEMBL29145107 0.80 L3MBTL1 (0.58) L3MBTL1ALDH1A1KMT2AASAH1CNR2
SCHEMBL29145083 0.80 CNR2 (0.59) L3MBTL1ALDH1A1KMT2AHTTASAH1
SCHEMBL29145151 0.80 CNR2 (0.64) L3MBTL1ALDH1A1KMT2AHTTCNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117430738-A Catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2024-01-23 CN claimed
CN-117430738-A Catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2024-01-23 CN disclosed
CN-117430737-A Catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2024-01-23 CN disclosed