SCHEMBL30816873

SCHEMBL30816873

O=C1CCN(c2cc(C(=O)N3CCC4(CCC(CN5CCNCC5)CC4)CC3)ccc2F)C(=O)N1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SOS1 Q07889 2/20 0.41
▸ FFAR4 Q5NUL3 3/20 0.40
▸ 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
▸ CYP2D6 P10635 3/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ CYP3A4 P08684 2/20 0.36
▸ USP2 O75604 1/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 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
SCHEMBL30066376 0.92 HSD11B1 (0.39) SOS1
SCHEMBL24671840 0.92 HSD11B1 (0.39) SOS1
SCHEMBL27123617 0.90 SOS1 (0.40) SOS1FFAR4GABRDGABRA1GABRB1
SCHEMBL30816878 0.90 GABRD (0.42) SOS1FFAR4GABRDGABRA1GABRB1
SCHEMBL30816877 0.90 SOS1 (0.41) SOS1FFAR4GABRDGABRA1GABRB1
SCHEMBL30816881 0.90 GABRD (0.42) SOS1FFAR4GABRDGABRA1GABRB1
SCHEMBL30816874 0.88 CYP2D6 (0.51) CYP2D6MAPK1CYP3A4USP2CYP1A2
SCHEMBL30816879 0.87 SOS1 (0.50) SOS1FFAR4GABRDGABRA1GABRB1
SCHEMBL30864017 0.87 SOS1 (0.46) SOS1FFAR4GABRDGABRA1GABRB1
SCHEMBL27117357 0.87 SOS1 (0.47) SOS1FFAR4

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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