SCHEMBL25822110

SCHEMBL25822110

COC(=O)c1ccc2c(c1)NC(=O)C1CCCC21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.54
HSD17B10 Q99714 2/20 0.54
HTT P42858 2/20 0.50
LMNA P02545 2/20 0.49
ALDH1A1 P00352 3/20 0.46
TSHR P16473 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
MAPK1 P28482 2/20 0.43
ATM Q13315 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALOX5 P09917 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
FGB P02675 1/20 0.40
HSP90AA1 P07900 1/20 0.40
HSP90AB1 P08238 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
CHRNB2 P17787 1/20 0.40

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
SCHEMBL26768084 0.86 ALOX15 (0.50) ALOX15HSD17B10HTTLMNAALDH1A1
SCHEMBL6069744 0.83 HSD17B10 (0.46) ALOX15HSD17B10HTTALDH1A1L3MBTL1
SCHEMBL31386670 0.78 ALOX15 (0.45) ALOX15HSD17B10HTTLMNAALDH1A1
SCHEMBL25822020 0.78 ALOX15 (0.45) ALOX15HSD17B10HTTLMNAALDH1A1
SCHEMBL6643305 0.78 NOS3 (0.48) LMNAALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL6642433 0.76 NOS3 (0.44) TSHRL3MBTL1CHRNB2CHRNA4GAA
SCHEMBL6069470 0.75 ALOX15 (0.38) ALOX15HSD17B10HTTLMNAALDH1A1
SCHEMBL12885350 0.74 ALDH1A1 (0.44) ALOX15HSD17B10HTTLMNAALDH1A1
SCHEMBL6069808 0.73 NOX1 (0.37) LMNATSHRSMN1; SMN2MEN1KMT2A
SCHEMBL6645276 0.73 NOS3 (0.44) MEN1KMT2A

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