SCHEMBL31482201

SCHEMBL31482201

CC(C)(C)OC(=O)N1CCC(N2CCC[C@H](C(C)(C)C)C2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.49
EPHX1 P07099 1/20 0.47
RECQL P46063 1/20 0.44
PARP1 P09874 1/20 0.43
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CTSD P07339 1/20 0.42
CTSE P14091 1/20 0.42
BACE1 P56817 1/20 0.42
GPR119 Q8TDV5 3/20 0.41
HCAR1 Q9BXC0 1/20 0.41
HSD17B10 Q99714 1/20 0.40
KDM4E B2RXH2 1/20 0.40
THRB P10828 1/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40

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
SCHEMBL16845137 0.84 HPGD (0.50) HPGDEPHX1RECQLPARP1MAPT
SCHEMBL994288 0.84 HPGD (0.58) HPGDEPHX1RECQLMAPTALDH1A1
SCHEMBL17128329 0.84 HPGD (0.62) HPGDEPHX1RECQLMAPTUSP2
SCHEMBL31482198 0.83 HPGD (0.49) HPGDEPHX1RECQLPARP1GPR119
SCHEMBL31482233 0.83 HPGD (0.49) HPGDEPHX1RECQLPARP1MAPT
SCHEMBL29307381 0.83 HPGD (0.49) HPGDEPHX1RECQLPARP1MAPT
SCHEMBL24183616 0.82 HPGD (0.51) HPGDEPHX1RECQLPARP1MAPT
SCHEMBL3160275 0.82 HPGD (0.65) HPGDEPHX1RECQLUSP2SMN1; SMN2
SCHEMBL12597751 0.82 MEN1 (0.55) HPGDEPHX1RECQLMAPTMEN1
SCHEMBL5514832 0.82 HPGD (0.65) HPGDEPHX1RECQLUSP2SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025068514-A1 SUBSTITUTED HETEROCYCLIC CARBOXAMINDES AND USE THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2025-04-03 WO disclosed