SCHEMBL31521219

SCHEMBL31521219

O=C1OCC12CCNCC2

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.36
NEK2 P51955 1/20 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
SCHEMBL9933786 0.79 CRBN (0.35) CRBNNEK2
Hydrochloric Acid SCHEMBL19520634 0.77 CRBN (0.34) CRBNNEK2
Hydrochloric Acid SCHEMBL29770078 0.77 CRBN (0.34) CRBNNEK2
SCHEMBL13898991 0.77
SCHEMBL11692223 0.77
SCHEMBL11691562 0.75
SCHEMBL2407499 0.73 KDM4E (0.32)
SCHEMBL21274164 0.71 CRBN (0.46) CRBN
SCHEMBL21315419 0.71 CRBN (0.46) CRBN
SCHEMBL16914478 0.68 CRBN (0.34) CRBNNEK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119790059-A Heterocyclic compounds as KRAS inhibitors, their preparation and therapeutic use 上海科州药物股份有限公司 2025-04-08 CN disclosed