SCHEMBL30059636

SCHEMBL30059636

CC(C)(C)OC(=O)N1CCC([Zn+])CC1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.58
RECQL P46063 1/20 0.55
EPHX1 P07099 1/20 0.55
USP2 O75604 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
GPR119 Q8TDV5 6/20 0.51
MAPT P10636 2/20 0.50
KDM4E B2RXH2 2/20 0.50
THRB P10828 1/20 0.50
PTPN2 P17706 1/20 0.50
PTPN1 P18031 1/20 0.50
PTPN6 P29350 1/20 0.50
ALDH1A1 P00352 2/20 0.48
NPC1 O15118 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PKM P14618 1/20 0.46

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
Iodide SCHEMBL362954 0.98 HPGD (0.57) HPGDRECQLEPHX1USP2SMN1; SMN2
Bromide SCHEMBL26117866 0.98 HPGD (0.57) HPGDRECQLEPHX1USP2SMN1; SMN2
Iodide SCHEMBL2455330 0.87 HPGD (0.50) HPGDRECQLEPHX1USP2SMN1; SMN2
SCHEMBL310117 0.84 GPR119 (0.67) HPGDRECQLEPHX1USP2SMN1; SMN2
SCHEMBL696090 0.84 HPGD (0.62) HPGDRECQLEPHX1USP2SMN1; SMN2
SCHEMBL2006303 0.82 HPGD (0.65) HPGDRECQLEPHX1USP2SMN1; SMN2
SCHEMBL16897017 0.82 HPGD (0.60) HPGDRECQLEPHX1USP2SMN1; SMN2
SCHEMBL13274147 0.82 GPR119 (0.65) HPGDRECQLEPHX1USP2SMN1; SMN2
Ethane SCHEMBL897978 0.82 HPGD (0.60) HPGDRECQLEPHX1USP2SMN1; SMN2
SCHEMBL1965735 0.82 USP2 (0.61) HPGDRECQLEPHX1USP2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025215110-A1 NEW AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS SOS1 INHIBITORS LES LABORATOIRES SERVIER (FR) 2025-10-16 WO disclosed
CN-111065626-B Compounds for the treatment of huntington's disease PTC医疗公司 2024-09-27 CN disclosed
CN-115485026-A Pyrazolo [1,2-D ] [1,2,4] triazin-2-yl-acetamides as NLRP3 inflammatory pathway inhibitors 詹森药业有限公司 2022-12-16 CN disclosed