SCHEMBL30816892

SCHEMBL30816892

[2H]C([2H])([2H])Oc1ccc(C(=O)N2CCC3(CCC(C=O)CC3)CC2)cc1N1CCC(=O)NC1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SOS1 Q07889 2/20 0.40
▸ CRBN Q96SW2 2/20 0.37
▸ MLKL Q8NB16 1/20 0.37
▸ TNKS O95271 1/20 0.36
▸ PARP1 P09874 1/20 0.36
▸ PARP10 Q53GL7 1/20 0.36
▸ TNKS2 Q9H2K2 1/20 0.36
▸ NR3C1 P04150 1/20 0.35
▸ PGR P06401 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ PDE3B Q13370 1/20 0.35
▸ PDE3A Q14432 1/20 0.35
▸ CYP2D6 P10635 3/20 0.34
▸ GABRD O14764 2/20 0.34
▸ GABRA1 P14867 2/20 0.34
▸ GABRB1 P18505 2/20 0.34
▸ GABRA5 P31644 2/20 0.34
▸ GABRA3 P34903 2/20 0.34
▸ GABRA2 P47869 2/20 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
SCHEMBL30816897 1.00 SOS1 (0.40) SOS1CRBNMLKLTNKSPARP1
SCHEMBL30816863 0.94 SOS1 (0.42) SOS1CRBNMLKLTNKSPARP1
SCHEMBL30816861 0.94 SOS1 (0.42) SOS1CRBNMLKLTNKSPARP1
SCHEMBL30816917 0.87 CRBN (0.35) CRBNTNKSPARP1PARP10TNKS2
SCHEMBL28978031 0.86 CRBN (0.42) CRBNTNKSPARP1PARP10TNKS2
SCHEMBL30266960 0.86 CRBN (0.42) CRBNTNKSPARP1PARP10TNKS2
SCHEMBL31722472 0.85 NR3C1 (0.43) TNKSPARP1PARP10TNKS2NR3C1
SCHEMBL25581205 0.85 NR3C1 (0.43) TNKSPARP1PARP10TNKS2NR3C1
SCHEMBL30816865 0.85 TNKS (0.37) SOS1CRBNTNKSPARP1PARP10
SCHEMBL30864019 0.85 ITGB3 (0.37) CRBNTNKSPARP1PARP10TNKS2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4631942-A1 PAN-KRAS DEGRADING AGENT, AND PREPARATION METHOD THEREFOR AND USE THEREOF Leadingtac Pharmaceutical (Shaoxing) Co., Ltd. (CN) 2025-10-15 — — EP disclosed
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
CN-117917416-A KRAS G12D 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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