SCHEMBL29348642

SCHEMBL29348642

O=C1CCC(c2cccc(-c3ccc(CN4CCCCC4=O)nc3)c2Cl)C(=O)N1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 9/20 0.39
DDB1 Q16531 8/20 0.39
CNR2 P34972 3/20 0.39
HRH3 Q9Y5N1 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
OPRK1 P41145 1/20 0.34
ENPP2 Q13822 1/20 0.34
CNR1 P21554 1/20 0.33
PDK2 Q15119 1/20 0.33
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
CYP2D6 P10635 1/20 0.33
IKZF3 Q9UKT9 1/20 0.33

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
SCHEMBL31068262 1.00 CRBN (0.39) CRBNDDB1CNR2HRH3L3MBTL1
SCHEMBL29348399 0.88 HRH3 (0.45) CRBNDDB1HRH3L3MBTL1IKZF3
SCHEMBL29348641 0.87 DDB1 (0.41) CRBNDDB1CNR2OPRK1
SCHEMBL31068165 0.87 DDB1 (0.37) CRBNDDB1CNR2PDK2
SCHEMBL29348640 0.87 DDB1 (0.37) CRBNDDB1CNR2PDK2
SCHEMBL31068183 0.87 DDB1 (0.41) CRBNDDB1CNR2OPRK1
SCHEMBL29348434 0.86 HRH3 (0.42) CRBNDDB1HRH3L3MBTL1IKZF3
SCHEMBL29348912 0.84 DDB1 (0.38) CRBNDDB1CNR2
SCHEMBL31068267 0.83 CNR2 (0.59) CRBNDDB1CNR2CNR1
SCHEMBL29348994 0.83 CNR2 (0.59) CRBNDDB1CNR2CNR1

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-2024151547-A1 TARGETED DEGRADATION OF VAV1 MONTE ROSA THERAPEUTICS, INC. (US) 2024-07-18 WO disclosed