SCHEMBL24662248

SCHEMBL24662248

C[C@@H](c1cccc(NC(=O)OC(C)(C)C)c1)c1nncn1C

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 19/20 0.46
▸ IDO1 P14902 1/20 0.44

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
SCHEMBL24662529 0.87 CBLB (0.50) CBLBIDO1
SCHEMBL22832474 0.85 CBLB (0.49) CBLBIDO1
SCHEMBL21200282 0.79 CBLB (0.51) CBLB
SCHEMBL29867199 0.79 CBLB (0.51) CBLB
SCHEMBL24661683 0.78 CBLB (0.47) CBLB
SCHEMBL12743181 0.77 FADS1 (0.51) IDO1
SCHEMBL22528071 0.77 CBLB (0.43) CBLBIDO1
SCHEMBL13734965 0.76 MEN1 (0.63) IDO1
SCHEMBL21377414 0.76 MEN1 (0.63) IDO1
SCHEMBL28360251 0.76 RXFP1 (0.48) IDO1

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-2022221704-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING CANCER HOTSPOT THERAPEUTICS, INC. (US) 2022-10-20 — — WO disclosed
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