SCHEMBL30267132

SCHEMBL30267132

[2H]C1CCN(CCOCC2CCN(C(=O)c3ccc(Cl)c(N4CCC(=O)NC4=O)c3)CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 7/20 0.39
▸ MGLL Q99685 3/20 0.38
▸ HTT P42858 1/20 0.35
▸ SPIN1 Q9Y657 1/20 0.35
▸ TSHR P16473 1/20 0.34
▸ LIPG Q9Y5X9 1/20 0.34
▸ DDB1 Q16531 1/20 0.34
▸ CRBN Q96SW2 1/20 0.34

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
SCHEMBL27146099 0.90 HRH3 (0.39) HRH3MGLLHTTTSHRLIPG
SCHEMBL27146833 0.89 MGLL (0.38) HRH3MGLLHTTTSHRLIPG
SCHEMBL27137616 0.85 CRBN (0.39) MGLLHTTDDB1CRBN
SCHEMBL27143092 0.84 MGLL (0.42) MGLLTSHRLIPG
SCHEMBL29201746 0.83 MGLL (0.39) MGLLTSHR
SCHEMBL31677239 0.83 DRD2 (0.45) —
SCHEMBL30931910 0.83 HRH3 (0.44) HRH3HTTSPIN1
SCHEMBL27124624 0.83 MGLL (0.41) MGLLTSHR
SCHEMBL30966215 0.83 MGLL (0.38) MGLLTSHR
SCHEMBL31697885 0.83 MGLL (0.39) MGLLTSHR

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-2023025159-A1 IRAK4 DEGRADATION AGENT, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海领泰生物医药科技有限公司 2023-03-02 — — WO disclosed
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