SCHEMBL28636011

SCHEMBL28636011

NC(=O)Oc1cccc(C=Cc2ccc(C=O)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.58
▸ MEN1 O00255 3/20 0.58
▸ NPC1 O15118 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ BLM P54132 1/20 0.47
▸ MCL1 Q07820 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ CYP19A1 P11511 2/20 0.46
▸ RELA Q04206 1/20 0.46
▸ MAPT P10636 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SRC P12931 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ NFE2L2 Q16236 1/20 0.43
▸ NQO2 P16083 1/20 0.43
▸ PARP10 Q53GL7 1/20 0.41
▸ PARP3 Q9Y6F1 1/20 0.41

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
SCHEMBL3821816 0.89 KMT2A (0.68) KMT2AMEN1NPC1POLBBLM
SCHEMBL28632725 0.84 MEN1 (0.53) KMT2AMEN1NPC1POLBBLM
SCHEMBL28637154 0.78 KMT2A (0.53) KMT2AMEN1NPC1L3MBTL1MAPT
SCHEMBL28924753 0.78 MEN1 (0.53) KMT2AMEN1POLBALDH1A1PARP10
SCHEMBL28636007 0.78 KMT2A (0.53) KMT2AMEN1NPC1POLBBLM
SCHEMBL28646238 0.78 KMT2A (0.53) KMT2AMEN1RAB9APARP10PARP3
SCHEMBL9903153 0.78 KMT2A (0.61) KMT2AMEN1NPC1POLBBLM
SCHEMBL10081937 0.77 KMT2A (0.58) KMT2AMEN1MAPTSMN1; SMN2ALDH1A1
SCHEMBL28647670 0.77 MEN1 (0.56) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL28652467 0.76 RAB9A (0.55) KMT2AMEN1NPC1RAB9APARP10

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
CN-109476699-B Glucocorticoid receptor agonists and immunoconjugates thereof 艾伯维公司 2021-10-12 — — CN disclosed
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