SCHEMBL30816879

SCHEMBL30816879

COc1ccc(C(=O)N2CCC3(CCC(CN4CCNCC4)CC3)CC2)cc1N1CCC(=O)NC1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SOS1 Q07889 2/20 0.50
▸ MLKL Q8NB16 1/20 0.40
▸ CRBN Q96SW2 1/20 0.40
▸ CYP2D6 P10635 4/20 0.40
▸ USP2 O75604 3/20 0.40
▸ FFAR4 Q5NUL3 2/20 0.39
▸ BRD9 Q9H8M2 1/20 0.39
▸ GABRD O14764 2/20 0.38
▸ GABRA1 P14867 2/20 0.38
▸ GABRB1 P18505 2/20 0.38
▸ GABRA5 P31644 2/20 0.38
▸ GABRA3 P34903 2/20 0.38
▸ GABRA2 P47869 2/20 0.38
▸ GABRB2 P47870 2/20 0.38
▸ GABRA4 P48169 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ KCNH2 Q12809 2/20 0.38
▸ NR3C1 P04150 1/20 0.38
▸ PGR P06401 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38

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
SCHEMBL31447662 0.92 SOS1 (0.44) SOS1KCNH2NR3C1PGRSLC6A4
SCHEMBL30864017 0.90 SOS1 (0.46) SOS1FFAR4GABRDGABRA1GABRB1
SCHEMBL30816878 0.89 GABRD (0.42) SOS1CRBNFFAR4GABRDGABRA1
SCHEMBL30816881 0.89 GABRD (0.42) SOS1CRBNFFAR4GABRDGABRA1
SCHEMBL30816877 0.89 SOS1 (0.41) SOS1FFAR4GABRDGABRA1GABRB1
SCHEMBL30864007 0.89 SOS1 (0.46) SOS1MLKLCRBNCYP2D6USP2
Hydrochloric Acid SCHEMBL30278940 0.88 SOS1 (0.45) SOS1KCNH2NR3C1PGRSLC6A4
SCHEMBL27117256 0.88 SOS1 (0.56) SOS1MLKLCRBNCYP2D6USP2
SCHEMBL30984835 0.88 SOS1 (0.51) SOS1MLKLCRBNCYP2D6USP2
SCHEMBL30816873 0.87 SOS1 (0.41) SOS1CYP2D6USP2FFAR4GABRD

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 4 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
EP-4606803-A1 KRAS G12D DEGRADATION AGENT, AND PREPARATION METHOD AND USE THEREFOR Leadingtac Pharmaceutical (Shaoxing) Co., Ltd. (CN) 2025-08-27 — — 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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