SCHEMBL29281606

SCHEMBL29281606

Cc1ccc(C(=O)N2CCC(COCCC3CCN(C(=O)O)CC3)CC2)cc1N1CCC(=O)NC1=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 4/20 0.38
▸ CRBN Q96SW2 4/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ TP53 P04637 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ GFER P55789 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ NPBWR1 P48145 1/20 0.35
▸ MCHR1 Q99705 1/20 0.35
▸ HTR7 P34969 1/20 0.35
▸ MGLL Q99685 1/20 0.34
▸ AKR1C3 P42330 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
SCHEMBL31697865 0.92 RBP4 (0.39) DDB1CRBNALDH1A1TP53HPGD
SCHEMBL31697794 0.90 GPR119 (0.41) DDB1CRBNKDM4EKMT2A
SCHEMBL28891876 0.90 NR3C1 (0.38) CRBNALDH1A1HPGDSMN1; SMN2HTT
SCHEMBL29201746 0.90 MGLL (0.39) MGLL
SCHEMBL27137184 0.88 HSD11B1 (0.35) HTR7MGLL
SCHEMBL27141895 0.87 MGLL (0.38) MGLL
SCHEMBL30014759 0.87 MGLL (0.38) MGLL
SCHEMBL28783557 0.84 DDB1 (0.44) DDB1CRBNALDH1A1TP53HPGD
SCHEMBL27143092 0.83 MGLL (0.42) MGLL
SCHEMBL27137025 0.82 RBP4 (0.38) CRBNALDH1A1HPGDSMN1; SMN2HTT

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-117917410-A Pan-KRAS degradation agent and preparation method and application thereof 上海领泰生物医药科技有限公司 2024-04-23 — — CN disclosed
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