SCHEMBL30200580

SCHEMBL30200580

Cc1ccc(S(=O)(=O)OCC2(CCCOCc3ccccc3)CCCCC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
GAA P10253 1/20 0.43
PKM P14618 1/20 0.43
MAPT P10636 2/20 0.39
ATM Q13315 1/20 0.39
CHRM3 P20309 3/20 0.37
LMNA P02545 3/20 0.37
CYP24A1 Q07973 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
AR P10275 1/20 0.36
FKBP1A P62942 1/20 0.35
ITGB1 P05556 1/20 0.35
ITGA4 P13612 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL9872267 0.80 ALDH1A1 (0.49) ALDH1A1GAAPKMMAPTATM
SCHEMBL2246161 0.80 ALDH1A1 (0.49) ALDH1A1GAAPKMMAPTATM
SCHEMBL26979071 0.79 ALDH1A1 (0.48) ALDH1A1GAAPKMMAPTATM
SCHEMBL29172709 0.79 ALDH1A1 (0.48) ALDH1A1GAAPKMMAPTATM
SCHEMBL25311278 0.79 ALDH1A1 (0.48) ALDH1A1GAAPKMMAPTATM
SCHEMBL25206305 0.79 ALDH1A1 (0.48) ALDH1A1GAAPKMMAPTATM
SCHEMBL2241875 0.79 ALDH1A1 (0.48) ALDH1A1GAAPKMMAPTATM
SCHEMBL9872166 0.79 ALDH1A1 (0.48) ALDH1A1GAAPKMMAPTATM
SCHEMBL7849587 0.78 KMT2A (0.50) ALDH1A1GAAPKMSMN1; SMN2KMT2A
SCHEMBL23250068 0.78 ALDH1A1 (0.47) ALDH1A1GAAPKMMAPTATM

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