SCHEMBL25327111

SCHEMBL25327111

CC1CC=C(c2ccc3cn(C)nc3c2)N(C(=O)OC(C)(C)C)C1.Cn1cc2ccc(B3OC(C)(C)C(C)(C)O3)cc2n1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.37
▸ SCD5 Q86SK9 1/20 0.34
▸ BRD4 O60885 1/20 0.33
▸ CREBBP Q92793 1/20 0.33
▸ BACE1 P56817 1/20 0.32
▸ BACE2 Q9Y5Z0 1/20 0.32
▸ PRMT5 O14744 1/20 0.32
▸ WDR77 Q9BQA1 1/20 0.32
▸ AAK1 Q2M2I8 1/20 0.32
▸ LPL P06858 1/20 0.31
▸ LIPG Q9Y5X9 1/20 0.31

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
SCHEMBL25324705 0.88 SCD5 (0.38) USP30SCD5BRD4CREBBP
SCHEMBL24366022 0.88 SCD5 (0.38) USP30SCD5BRD4CREBBP
SCHEMBL30886968 0.81 GRM5 (0.37) —
SCHEMBL25914460 0.81 GRM5 (0.37) —
SCHEMBL30886178 0.81 GRM5 (0.37) —
SCHEMBL25324334 0.80 PIK3CD (0.41) USP30BRD4CREBBPBACE1BACE2
SCHEMBL25324329 0.80 PIK3CD (0.41) USP30BRD4CREBBPBACE1BACE2
SCHEMBL25321630 0.78 TYK2 (0.34) LPLLIPG
SCHEMBL25321628 0.78 TYK2 (0.34) LPLLIPG
SCHEMBL25323073 0.78 LIPG (0.32) LPLLIPG

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-2023146990-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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