SCHEMBL29478872

SCHEMBL29478872

CC1(C)CCc2c(cc(Br)c(N)c2Br)C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CES1 P23141 2/20 0.33
▸ LIMK1 P53667 1/20 0.33
▸ MEN1 O00255 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL24373030 1.00 CES1 (0.33) CES1LIMK1MEN1TSHRKMT2A
SCHEMBL24373031 0.76 MAPK1 (0.34) CES1
SCHEMBL29478793 0.76 MAPK1 (0.34) CES1
SCHEMBL6770814 0.71 MEN1 (0.39) MEN1TSHRKMT2A
SCHEMBL30572444 0.71 MEN1 (0.39) MEN1TSHRKMT2A
SCHEMBL30421685 0.67 CES1 (0.41) CES1
SCHEMBL20398744 0.65 CES1 (0.42) CES1
SCHEMBL15829226 0.63 CD44 (0.44) CES1LIMK1MEN1TSHRKMT2A
SCHEMBL24373489 0.62 MEN1 (0.32) MEN1TSHRKMT2A
SCHEMBL29479092 0.62 MEN1 (0.32) MEN1TSHRKMT2A

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
EP-4232444-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2023-08-30 — — EP disclosed
WO-2022083569-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2022-04-28 — — WO disclosed
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