SCHEMBL28891876

SCHEMBL28891876

COc1ccc(C(=O)N2CCC(COCCC3CCN(C(=O)O)CC3)CC2)cc1N1CCC(=O)NC1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 1/20 0.38
▸ PGR P06401 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ PDE3B Q13370 1/20 0.38
▸ PDE3A Q14432 1/20 0.38
▸ SOS1 Q07889 2/20 0.38
▸ LMNA P02545 2/20 0.37
▸ MGLL Q99685 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ HPGD P15428 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ TNKS O95271 1/20 0.36
▸ PARP1 P09874 1/20 0.36
▸ PARP10 Q53GL7 1/20 0.36
▸ TNKS2 Q9H2K2 1/20 0.36

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
SCHEMBL27137025 0.93 RBP4 (0.38) NR3C1PGRSLC6A4KCNH2PDE3B
SCHEMBL27141895 0.91 MGLL (0.38) SLC6A4SOS1MGLL
SCHEMBL30014759 0.91 MGLL (0.38) SLC6A4SOS1MGLL
SCHEMBL27121298 0.90 GPR119 (0.43) ALDH1A1BACE1CRBN
SCHEMBL31697911 0.90 GPR119 (0.43) ALDH1A1BACE1CRBN
SCHEMBL29281606 0.90 DDB1 (0.38) MGLLALDH1A1KDM4EHPGDHTT
SCHEMBL29201746 0.88 MGLL (0.39) MGLL
SCHEMBL27137184 0.87 HSD11B1 (0.35) MGLL
SCHEMBL31586935 0.86 NR3C1 (0.41) NR3C1PGRSLC6A4KCNH2PDE3B
SCHEMBL31586917 0.86 NR3C1 (0.42) NR3C1PGRSLC6A4KCNH2PDE3B

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
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-115232111-A SOS1 degradation agent and preparation method and application thereof 上海领泰生物医药科技有限公司 2022-10-25 — — CN disclosed
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