SCHEMBL23925182

SCHEMBL23925182

COCCC1C(=O)NCCN1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
LMNA P02545 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 3/20 0.44
KMT2A Q03164 4/20 0.42
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 1/20 0.40
GAA P10253 1/20 0.39

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
SCHEMBL7412000 0.85 DPP4 (0.51) TSHRLMNAL3MBTL1KDM4EKMT2A
SCHEMBL7497591 0.85 DPP4 (0.51) TSHRLMNAL3MBTL1KDM4EKMT2A
SCHEMBL1584098 0.81 TSHR (0.48) TSHRLMNAL3MBTL1KDM4EKMT2A
SCHEMBL4388067 0.79 KMT2A (0.52) LMNAKDM4EKMT2AALDH1A1MAPK1
SCHEMBL22440090 0.78 TSHR (0.46) TSHRLMNAL3MBTL1KDM4EKMT2A
Dimethylamine SCHEMBL28896303 0.76 TSHR (0.49) TSHRLMNAL3MBTL1KDM4EKMT2A
SCHEMBL2299168 0.75 DPP4 (0.53) TSHRLMNAL3MBTL1KDM4EKMT2A
SCHEMBL29171350 0.75 DPP4 (0.53) TSHRLMNAL3MBTL1KDM4EKMT2A
SCHEMBL9003054 0.74 KMT2A (0.68) TSHRLMNAL3MBTL1KDM4EKMT2A
SCHEMBL9003051 0.74 KMT2A (0.68) TSHRLMNAL3MBTL1KDM4EKMT2A

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
EP-4136084-A1 BCL-2 INHIBITOR BeiGene, Ltd. (KY) 2023-02-22 EP disclosed
WO-2021208963-A1 BCL-2 INHIBITOR BEIGENE, LTD. (KY) 2021-10-21 WO disclosed