SCHEMBL30987166

SCHEMBL30987166

CC1(O)CCO[C@H](C(=O)O)CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RORC P51449 10/20 0.40
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PDK1 Q15118 1/20 0.36
RECQL P46063 1/20 0.36
NR1H2 P55055 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
HPGD P15428 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
SCHEMBL30987027 0.87 RORC (0.41) RORCUSP2SMN1; SMN2RECQLNR1H2
SCHEMBL30987087 0.87 RORC (0.41) RORCUSP2SMN1; SMN2RECQLNR1H2
SCHEMBL30987170 0.87 RORC (0.41) RORCUSP2SMN1; SMN2RECQLNR1H2
SCHEMBL30987177 0.81 NR1H2 (0.43) RORCUSP2SMN1; SMN2PDK1RECQL
SCHEMBL30987199 0.80 MAPT (0.40) RORCUSP2SMN1; SMN2RECQLNR1H2
SCHEMBL194709 0.79 USP2 (0.54) USP2SMN1; SMN2PDK1RECQLNR1H2
SCHEMBL194710 0.79 USP2 (0.54) USP2SMN1; SMN2PDK1RECQLNR1H2
SCHEMBL59641 0.79 USP2 (0.54) USP2SMN1; SMN2PDK1RECQLNR1H2
SCHEMBL25869375 0.79 RORC (0.39) RORCUSP2SMN1; SMN2RECQLNR1H2
SCHEMBL30987036 0.79 USP2 (0.38) RORCUSP2SMN1; SMN2PDK1RECQL

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-4646265-A1 NOVEL, REVERSIBLE DPP1 INHIBITORS AND USES THEREOF Insmed Incorporated (US) 2025-11-12 EP disclosed
WO-2024148308-A1 NOVEL, REVERSIBLE DPP1 INHIBITORS AND USES THEREOF INSMED INCORPORATED (US) 2024-07-11 WO disclosed