SCHEMBL30200719

SCHEMBL30200719

CCOC(=O)CCCCCCCS(=O)(=O)N(Cc1ccc(OC)cc1)Cc1ccc(OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
APLNR P35414 3/20 0.48
BMP1 P13497 2/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
BCHE P06276 1/20 0.46
ACHE P22303 1/20 0.46
TAS2R14 Q9NYV8 5/20 0.45
CNR2 P34972 1/20 0.43
PTGES O14684 1/20 0.42
TAS2R8 Q9NYW2 1/20 0.42
CXCR3 P49682 1/20 0.42
TBXAS1 P24557 1/20 0.42

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
SCHEMBL7003011 0.78 BMP1 (0.73) ALDH1A1BMP1KMT2A
SCHEMBL3675681 0.78 ALOX5 (0.57) KMT2A
SCHEMBL27266465 0.77 APLNR (0.58) ALDH1A1APLNRBMP1TAS2R14PTGES
SCHEMBL27266410 0.77 APLNR (0.58) APLNRBMP1TAS2R14PTGESTAS2R8
SCHEMBL7999711 0.76 ALOX5 (0.59) KMT2A
SCHEMBL16235820 0.76 APLNR (0.65) APLNRBMP1TAS2R14CNR2PTGES
SCHEMBL3586758 0.75 APLNR (0.59) ALDH1A1APLNRBMP1TAS2R14PTGES
SCHEMBL19285058 0.75 APLNR (0.59) APLNRBMP1TAS2R14PTGESTAS2R8
SCHEMBL1239542 0.75 ALOX5 (0.65) ALDH1A1KMT2A
SCHEMBL26646257 0.75 APLNR (0.55) ALDH1A1APLNRBMP1TAS2R14PTGES

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