SCHEMBL31360588

SCHEMBL31360588

Brc1cccc(OC2CCc3ccccc32)c1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 4/20 0.50
▸ SLC6A4 P31645 4/20 0.46
▸ SLC6A2 P23975 1/20 0.46
▸ SLC6A3 Q01959 1/20 0.46
▸ GFRA2 O00451 1/20 0.43
▸ GFRA3 O60609 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ FFAR1 O14842 3/20 0.41
▸ GID4 Q8IVV7 1/20 0.39

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
SCHEMBL14969006 0.83 SLC6A4 (0.46) IDO1SLC6A4SLC6A2SLC6A3GFRA3
SCHEMBL12017975 0.82 IDO1 (0.61) IDO1SLC6A4SLC6A2SLC6A3GFRA2
SCHEMBL8530467 0.82 IDO1 (0.50) IDO1GFRA2GFRA3FFAR1GID4
SCHEMBL1746643 0.82 IDO1 (0.50) IDO1SLC6A4SLC6A2SLC6A3GFRA2
SCHEMBL29279370 0.80 SLC6A4 (0.44) IDO1SLC6A4SLC6A2SLC6A3FFAR1
SCHEMBL1744666 0.78 GFRA3 (0.53) IDO1GFRA2GFRA3FFAR1
SCHEMBL20502292 0.75 IDO1 (0.43) IDO1SLC6A4GFRA2GFRA3FFAR1
SCHEMBL1746749 0.75 IDO1 (0.49) IDO1SLC6A4FFAR1
SCHEMBL14968921 0.75 IDO1 (0.43) IDO1SLC6A4SLC6A2SLC6A3FFAR1
SCHEMBL1746652 0.74 GFRA3 (0.63) IDO1GFRA2GFRA3FFAR1

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-2024255856-A1 COMPOUND FOR REGULATING TEAD ACTIVITY, PREPARATION METHOD THEREFOR, AND USE THEREOF 赛诺哈勃药业(成都)有限公司 2024-12-19 — — WO disclosed
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