SCHEMBL25880948

SCHEMBL25880948

CC(C)(C)OC(=O)N1CC2CN(C(=O)c3cccc(-c4cn5ccccc5n4)c3)CC2C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.49
ALDH1A1 P00352 10/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
HPGD P15428 5/20 0.49
LMNA P02545 5/20 0.48
HSD17B10 Q99714 3/20 0.48
GAA P10253 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
RAB9A P51151 3/20 0.48
POLB P06746 3/20 0.48
GFER P55789 1/20 0.48
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46
KCNK3 O14649 3/20 0.45
KCNK9 Q9NPC2 3/20 0.45
MAPT P10636 3/20 0.45
KMT2A Q03164 2/20 0.45
MAPK1 P28482 2/20 0.45
USP2 O75604 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
SCHEMBL25310936 0.89 KDM4E (0.58) KDM4EALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL25882701 0.85 KDM4E (0.56) KDM4EALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL30471101 0.82 KDM4E (0.54) KDM4EALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL25310339 0.82 KDM4E (0.53) KDM4EALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL25880869 0.80 NAMPT (0.49) KDM4EALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL29484616 0.80 NAMPT (0.49) KDM4EALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL25311377 0.79 KDM4E (0.62) KDM4EALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL25881998 0.78 KDM4E (0.46) KDM4EALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL19322175 0.77 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL25878144 0.77 KDM4E (0.57) KDM4EALDH1A1SMN1; SMN2HPGDLMNA

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-4215526-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2023-07-26 EP disclosed