Sugi Predict

Sugi Predict / Compounds / SCHEMBL30864045

SCHEMBL30864045

SCHEMBL30864045

COCOc1cc(-c2ncc3c(N4CC5CCC(C4)N5C(=O)OC(C)(C)C)nc(OCC(C)(C)CO)nc3c2F)c2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c(F)ccc2c1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KRAS P01116 20/20 0.39
▸ MAPK3 P27361 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ RAF1 P04049 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
SCHEMBL30493773 0.95 KRAS (0.40) KRASMAPK3MAPK1RAF1
SCHEMBL25331029 0.95 KRAS (0.40) KRASMAPK3MAPK1RAF1
SCHEMBL31129488 0.93 KRAS (0.39) KRASMAPK3MAPK1RAF1
SCHEMBL31129721 0.92 KRAS (0.39) KRASMAPK3MAPK1RAF1
SCHEMBL31129533 0.92 KRAS (0.39) KRASMAPK3MAPK1RAF1
SCHEMBL25309201 0.92 KRAS (0.39) KRASMAPK3MAPK1RAF1
SCHEMBL31129339 0.92 KRAS (0.39) KRASMAPK3MAPK1RAF1
SCHEMBL31129481 0.91 KRAS (0.41) KRASMAPK3MAPK1RAF1
SCHEMBL31323525 0.91 KRAS (0.41) KRASMAPK3MAPK1RAF1
SCHEMBL30260027 0.91 KRAS (0.36) KRASMAPK3MAPK1RAF1

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
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-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