SCHEMBL30200836

SCHEMBL30200836

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)CCN(C)CCC(=O)OCc2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 7/20 0.48
CXCR3 P49682 2/20 0.48
PTGES O14684 1/20 0.48
TAS2R8 Q9NYW2 1/20 0.48
ACHE P22303 1/20 0.48
BMP1 P13497 1/20 0.47
LTA4H P09960 2/20 0.44
APLNR P35414 1/20 0.43
LMNA P02545 1/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43

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
SCHEMBL30200470 0.87 ALDH1A1 (0.48) TAS2R14CXCR3PTGESTAS2R8ACHE
SCHEMBL1616048 0.79 TAS2R14 (0.58) TAS2R14CXCR3PTGESTAS2R8ACHE
SCHEMBL31626600 0.77 LMNA (0.52) LTA4HLMNA
SCHEMBL6122068 0.75 TRPM8 (0.48) BMP1LTA4H
SCHEMBL14072159 0.75 ALDH1A1 (0.53) LTA4HLMNA
SCHEMBL30200699 0.74 TAS2R14 (0.46) TAS2R14CXCR3PTGESTAS2R8APLNR
SCHEMBL305162 0.74 MAPT (0.68) LMNA
SCHEMBL26023562 0.74 MAPT (0.68) LMNA
SCHEMBL30200646 0.73 ALDH1A1 (0.50) TAS2R14CXCR3PTGESTAS2R8ACHE
SCHEMBL7004788 0.73 BMP1 (0.66) TAS2R14CXCR3PTGESTAS2R8BMP1

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-4401729-A1 BCL-XL DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2024-07-24 EP disclosed
WO-2023044046-A1 BCL-XL DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-03-23 WO disclosed