SCHEMBL24670705

SCHEMBL24670705

O=C1CCC(c2cnc(N3CCC(CO)CC3)c(F)c2)C(=O)N1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 17/20 0.39
DDB1 Q16531 15/20 0.39
LCAT P04180 1/20 0.35
SYK P43405 1/20 0.35
PDE10A Q9Y233 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
SCHEMBL30066348 1.00 CRBN (0.39) CRBNDDB1LCATSYKPDE10A
SCHEMBL24880727 0.89 FFAR4 (0.39) CRBNDDB1
SCHEMBL24880883 0.88 CRBN (0.36) CRBNDDB1LCAT
SCHEMBL24881066 0.87 CRBN (0.43) CRBNDDB1
SCHEMBL31583448 0.87 CRBN (0.43) CRBNDDB1
Hydrochloric Acid SCHEMBL31583577 0.86 CRBN (0.43) CRBNDDB1
SCHEMBL24881292 0.86 CRBN (0.44) CRBNDDB1LCAT
SCHEMBL24880878 0.85 POLB (0.35) CRBNDDB1
SCHEMBL24671454 0.84 CRBN (0.40) CRBNDDB1LCAT
SCHEMBL30066549 0.84 CRBN (0.40) CRBNDDB1LCAT

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
CN-117693502-A Compounds for inhibiting or degrading ITK, compositions comprising the same, methods of making the same, and methods of using the same 纽力克斯治疗公司 2024-03-12 CN disclosed
WO-2022235715-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE NURIX THERAPEUTICS, INC. (US) 2022-11-10 WO disclosed