SCHEMBL23402673

SCHEMBL23402673

Cc1ccc(-c2c(-c3cccc(C)c3)[nH]n(C)c2=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALKBH3 Q96Q83 1/20 0.43
▸ MAPK14 Q16539 5/20 0.41
▸ TGFBR1 P36897 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ FYN P06241 1/20 0.38
▸ CLK4 Q9HAZ1 1/20 0.38
▸ DYRK1B Q9Y463 1/20 0.38
▸ HPGD P15428 1/20 0.37
▸ PPARG P37231 1/20 0.37
▸ NCOA2 Q15596 1/20 0.37
▸ NCOA1 Q15788 1/20 0.37
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NOTUM Q6P988 1/20 0.36
▸ PARP10 Q53GL7 1/20 0.36
▸ PARP11 Q9NR21 1/20 0.36
▸ TDP2 O95551 1/20 0.36
▸ MAT2A P31153 1/20 0.36

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
SCHEMBL23399721 0.93 ALKBH3 (0.46) ALKBH3MAPK14L3MBTL1KDM4EALDH1A1
SCHEMBL23400963 0.86 KDM4E (0.50) ALKBH3KDM4EALDH1A1KMT2AMAT2A
SCHEMBL23399520 0.86 KDM4E (0.50) ALKBH3KDM4EALDH1A1KMT2AMAT2A
SCHEMBL23401873 0.86 ADORA2A (0.41) ALKBH3L3MBTL1KDM4EALDH1A1HPGD
SCHEMBL23402190 0.83 ALKBH3 (0.49) ALKBH3L3MBTL1KDM4EHPGDPPARG
SCHEMBL23398851 0.82 ALKBH3 (0.39) ALKBH3MAPK14TGFBR1KDM4EALDH1A1
SCHEMBL23400180 0.82 ALKBH3 (0.43) ALKBH3MAPK14TGFBR1L3MBTL1KDM4E
SCHEMBL23402357 0.82 ALKBH3 (0.40) ALKBH3MAPK14TGFBR1L3MBTL1ALDH1A1
SCHEMBL23401761 0.82 MAPK14 (0.41) ALKBH3MAPK14TGFBR1L3MBTL1ALDH1A1
SCHEMBL23401049 0.81 MAPK14 (0.41) ALKBH3MAPK14TGFBR1L3MBTL1KDM4E

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-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 — — EP disclosed
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