SCHEMBL30845401

SCHEMBL30845401

CC(C)(C)OC(=O)N1CCC(OCCN2CCC(F)(F)C2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
HPGD P15428 1/20 0.40
GPR119 Q8TDV5 6/20 0.38
RECQL P46063 1/20 0.38
EPHX1 P07099 1/20 0.38
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
KDM1A O60341 1/20 0.37
IDH1 O75874 1/20 0.36
IDH2 P48735 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL21813408 0.83 NPC1 (0.37) NPC1
SCHEMBL78659 0.81 HPGD (0.52) PRMT5WDR77HPGDGPR119RECQL
SCHEMBL15771046 0.81 BACE1 (0.43) HPGDGPR119RECQLEPHX1KDM1A
SCHEMBL78365 0.80 HPGD (0.55) PRMT5WDR77HPGDGPR119RECQL
SCHEMBL77972 0.78 RECQL (0.56) PRMT5WDR77HPGDGPR119RECQL
SCHEMBL22835640 0.77 HPGD (0.49) PRMT5WDR77HPGDGPR119RECQL
SCHEMBL27145651 0.77 HPGD (0.49) PRMT5WDR77HPGDGPR119RECQL
SCHEMBL1576027 0.76 HPGD (0.50) PRMT5WDR77HPGDGPR119RECQL
SCHEMBL2149148 0.76 HPGD (0.50) PRMT5WDR77HPGDGPR119RECQL
SCHEMBL21722940 0.75 HPGD (0.45) HPGDGPR119RECQLEPHX1NPC1

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
CN-113423711-B Thieno [3,2-B ] pyridine derivatives as UDP glycosyltransferase inhibitors and methods of use thereof 建新公司 2024-03-15 CN disclosed