SCHEMBL31250880

SCHEMBL31250880

COC(=O)CCCN1CC[C@@H](NC(=O)OC(C)(C)C)C1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.51
HRH2 P25021 4/20 0.47
HRH1 P35367 4/20 0.47
KCNA3 P22001 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
HSD11B1 P28845 4/20 0.44
CYP2C9 P11712 1/20 0.44
CCR5 P51681 1/20 0.41
DRD2 P14416 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
JAK2 O60674 2/20 0.39
JAK1 P23458 2/20 0.39
BTK Q06187 1/20 0.39

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
SCHEMBL31250707 0.93 CA1 (0.51) CTSKHRH2HRH1KCNA3CA1
SCHEMBL7578857 0.92 KCNA3 (0.52) CTSKHRH2HRH1KCNA3CA1
SCHEMBL31250540 0.89 CTSK (0.48) CTSKHRH2HRH1KCNA3CA1
SCHEMBL31665575 0.89 KCNA3 (0.51) CTSKKCNA3CA1CA2HSD11B1
SCHEMBL31250722 0.89 CTSK (0.52) CTSKHRH2HRH1KCNA3CA1
SCHEMBL24001253 0.88 KCNA3 (0.50) CTSKKCNA3CA1CA2HSD11B1
SCHEMBL13583442 0.86 CTSK (0.54) CTSKHRH2HRH1KCNA3CA1
SCHEMBL13583443 0.86 CTSK (0.54) CTSKHRH2HRH1KCNA3CA1
SCHEMBL21584005 0.85 CTSK (0.53) CTSKHRH2HRH1KCNA3CA1
SCHEMBL24036902 0.85 CTSK (0.53) CTSKHRH2HRH1KCNA3CA1

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-4720058-A2 BIFUNCTIONAL DEGRADERS AND USES THEREOF Casma Therapeutics, Inc. (US) 2026-04-08 EP disclosed
WO-2024249291-A2 BIFUNCTIONAL DEGRADERS AND USES THEREOF CASMA THERAPEUTICS, INC. (US) 2024-12-05 WO disclosed