SCHEMBL25396281

SCHEMBL25396281

O=C(O)C1CCN2C(=O)CCC2C1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
AKR1C3 P42330 2/20 0.39
AKR1C2 P52895 1/20 0.39
KMT2A Q03164 5/20 0.36
MEN1 O00255 3/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
NOTUM Q6P988 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTT P42858 1/20 0.33
DUSP3 P51452 1/20 0.33
AKR1C1 Q04828 1/20 0.33

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
SCHEMBL20590486 1.00 POLB (0.40) POLBGAAAKR1C3AKR1C2KMT2A
SCHEMBL25396029 0.84 KMT2A (0.35) AKR1C3AKR1C2KMT2AMEN1NPC1
SCHEMBL20224687 0.81 NPY5R (0.41) POLBGAAAKR1C3KMT2AMEN1
SCHEMBL25396793 0.80 BRD4 (0.41) POLBGAAKMT2ANPC1RAB9A
SCHEMBL18319142 0.77 LMNA (0.37) AKR1C3AKR1C2KMT2AMEN1NPC1
SCHEMBL19277294 0.77 LMNA (0.37) AKR1C3AKR1C2KMT2AMEN1NPC1
SCHEMBL28508116 0.77 LMNA (0.37) AKR1C3AKR1C2KMT2AMEN1NPC1
SCHEMBL25397572 0.76 KMT2A (0.36) AKR1C3AKR1C2KMT2ANPC1RAB9A
SCHEMBL25087123 0.75 SMN1; SMN2 (0.35) POLBGAAKMT2AMEN1NPC1
SCHEMBL2319362 0.75 ALDH1A1 (0.39) POLBAKR1C3AKR1C2NPC1RAB9A

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-2023155886-A1 PYRAZOLOPYRIDINE COMPOUNDS AS TAM INHIBITORS SHANGHAI ANTENGENE CORPORATION LIMITED (CN) 2023-08-24 WO disclosed