SCHEMBL30981269

SCHEMBL30981269

CC(C)(C)OC(=O)N1C[C@@H]2C(CN3CCC(NC(=O)OCc4ccccc4)CC3)[C@@H]2C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.50
▸ CTSL P07711 1/20 0.49
▸ CTSB P07858 1/20 0.49
▸ CTSK P43235 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.47
▸ GAA P10253 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ TSHR P16473 1/20 0.46
▸ MAPT P10636 2/20 0.46
▸ MAPK1 P28482 2/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ NTSR1 P30989 1/20 0.46
▸ DPP4 P27487 5/20 0.46
▸ DPP7 Q9UHL4 5/20 0.46
▸ KCNH2 Q12809 3/20 0.46
▸ KCNA3 P22001 1/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ EPHX1 P07099 1/20 0.43

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
SCHEMBL29259974 0.90 CTSL (0.51) HSD11B1CTSLCTSBCTSKALDH1A1
SCHEMBL30981426 0.87 HSD11B1 (0.52) HSD11B1CTSLCTSBCTSKALDH1A1
SCHEMBL30750698 0.87 L3MBTL1 (0.52) HSD11B1CTSLCTSBCTSKALDH1A1
SCHEMBL7870 0.86 L3MBTL1 (0.58) HSD11B1CTSLCTSBCTSKALDH1A1
SCHEMBL30732268 0.84 SMN1; SMN2 (0.48) NPSR1KMT2AMEN1JAK2JAK1
SCHEMBL951887 0.84 HSD11B1 (0.65) HSD11B1CTSLCTSBCTSKALDH1A1
SCHEMBL3726979 0.84 HSD11B1 (0.65) HSD11B1CTSLCTSBCTSKALDH1A1
SCHEMBL6944572 0.84 HSD11B1 (0.65) HSD11B1CTSLCTSBCTSKALDH1A1
SCHEMBL29232309 0.84 ALDH1A1 (0.53) HSD11B1CTSLCTSBCTSKALDH1A1
SCHEMBL29179827 0.83 ALDH1A1 (0.49) HSD11B1CTSLCTSBCTSKALDH1A1

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-4652161-A1 2,4-DIANILINOPYRIMIDINE-BASED AURORA-A KINASE SELECTIVE DEGRADATION INDUCING COMPOUNDS Uppthera, Inc. (KR) 2025-11-26 — — EP disclosed
WO-2024155112-A1 2,4-DIANILINOPYRIMIDINE-BASED AURORA-A KINASE SELECTIVE DEGRADATION INDUCING COMPOUNDS UPPTHERA, INC. (KR) 2024-07-25 — — WO disclosed
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