SCHEMBL25822020

SCHEMBL25822020

COC(=O)c1cnc2c(c1)NC(=O)C1CCCC21

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.45
HSD17B10 Q99714 1/20 0.45
HTT P42858 1/20 0.41
LMNA P02545 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.39
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 2/20 0.36
ATM Q13315 1/20 0.36
OPRK1 P41145 1/20 0.36
IP6K1 Q92551 1/20 0.35
KDM4E B2RXH2 1/20 0.35
PSMD14 O00487 1/20 0.34
SPR P35270 1/20 0.34
CRBN Q96SW2 2/20 0.34
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33

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
SCHEMBL31386670 1.00 ALOX15 (0.45) ALOX15HSD17B10HTTLMNAL3MBTL1
SCHEMBL24307314 0.87 ALOX15 (0.41) ALOX15HSD17B10HTTLMNAL3MBTL1
SCHEMBL25822110 0.78 ALOX15 (0.54) ALOX15HSD17B10HTTLMNAL3MBTL1
SCHEMBL21932249 0.74 MAPK1 (0.38) ALOX15HSD17B10HTTLMNAL3MBTL1
SCHEMBL31065610 0.74 MAPK1 (0.38) ALOX15HSD17B10HTTLMNAL3MBTL1
SCHEMBL25320261 0.73 TNKS (0.32) ALOX15HSD17B10ALDH1A1IP6K1KDM4E
SCHEMBL707607 0.72 HSD17B10 (0.65) ALOX15HSD17B10HTTLMNAL3MBTL1
SCHEMBL707606 0.72 HSD17B10 (0.65) ALOX15HSD17B10HTTLMNAL3MBTL1
SCHEMBL707735 0.72 ALOX15 (0.56) ALOX15HSD17B10HTTLMNAL3MBTL1
SCHEMBL707736 0.72 ALOX15 (0.56) ALOX15HSD17B10HTTLMNAL3MBTL1

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
WO-2023133413-A1 MULTICYCLIC COMPOUNDS SLAP PHARMACEUTICALS LLC (US) 2023-07-13 WO disclosed