SCHEMBL31487411

SCHEMBL31487411

COc1cccc(C(=O)NC2CC3(CCN(CC4CCN(c5ccc(C6CCC(=O)NC6=O)nc5C)CC4)CC3)C2)c1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 4/20 0.39
▸ LMNA P02545 1/20 0.38
▸ CCR3 P51677 1/20 0.38
▸ DDB1 Q16531 2/20 0.37
▸ CRBN Q96SW2 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ AKT1 P31749 1/20 0.36
▸ DRD4 P21917 2/20 0.36
▸ USP2 O75604 1/20 0.35
▸ POLB P06746 1/20 0.35

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
SCHEMBL31487464 0.89 LMNA (0.39) MCHR1LMNACCR3DDB1CRBN
SCHEMBL30475451 0.88 DDB1 (0.43) MCHR1LMNACCR3DDB1CRBN
SCHEMBL30475450 0.87 DDB1 (0.43) MCHR1LMNACCR3DDB1CRBN
SCHEMBL30479054 0.87 DDB1 (0.43) MCHR1LMNACCR3DDB1CRBN
SCHEMBL30479041 0.83 POLB (0.40) MCHR1LMNACCR3DDB1CRBN
SCHEMBL30923253 0.83 DDB1 (0.42) MCHR1LMNACCR3DDB1CRBN
SCHEMBL31487395 0.82 CCR3 (0.39) MCHR1LMNACCR3DDB1CRBN
SCHEMBL30923284 0.81 DDB1 (0.42) MCHR1CCR3DDB1CRBNDRD4
SCHEMBL30479036 0.80 DDB1 (0.41) MCHR1LMNACCR3DDB1CRBN
SCHEMBL30479074 0.80 L3MBTL1 (0.40) DDB1CRBNALDH1A1

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
CN-119790057-A Novel PLK1 degradation inducing compounds 厄普特拉株式会社 2025-04-08 — — CN disclosed
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