SCHEMBL30850436

SCHEMBL30850436

O=C1CCC(N2C(=O)c3ccc(C#CCCCCCCO)cc3C2=O)C(=O)N1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 18/20 0.57
DDB1 Q16531 13/20 0.55
ALDH1A1 P00352 1/20 0.53
CHRM2 P08172 1/20 0.53
OPRM1 P35372 1/20 0.53
IKZF3 Q9UKT9 1/20 0.53
CYP1A2 P05177 1/20 0.53
TSHR P16473 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
GSK3B P49841 1/20 0.48

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
SCHEMBL29440002 1.00 CRBN (0.57) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL30850398 1.00 CRBN (0.57) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL22512064 1.00 CRBN (0.57) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL31622253 1.00 CRBN (0.57) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL24289609 0.99 CRBN (0.58) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL21070782 0.96 CRBN (0.60) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL20442699 0.92 CRBN (0.62) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL25566308 0.90 CRBN (0.57) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL22512040 0.88 CRBN (0.55) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29439984 0.88 CRBN (0.55) CRBNDDB1ALDH1A1CHRM2OPRM1

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-2024102970-A1 COMPOUNDS FOR MODULATING SYK ACTIVITY AND E3 UBIQUITIN LIGASE ACTIVITY Kronos Bio, Inc. (US) 2024-05-16 WO disclosed