SCHEMBL25830645

SCHEMBL25830645

C#CCOCCOCCOCCOC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.45
RECQL P46063 1/20 0.43
GPR119 Q8TDV5 6/20 0.41
EPHX1 P07099 1/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPN6 P29350 1/20 0.40
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
STS P08842 1/20 0.38

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
SCHEMBL21070524 0.99 HPGD (0.46) HPGDRECQLGPR119EPHX1PTPN2
SCHEMBL21996737 0.93 HPGD (0.45) HPGDRECQLGPR119EPHX1PTPN2
SCHEMBL15991248 0.87 HPGD (0.51) HPGDRECQLGPR119EPHX1PTPN2
SCHEMBL30042725 0.86 HPGD (0.46) HPGDRECQLGPR119EPHX1PTPN2
SCHEMBL21997260 0.84 HPGD (0.49) HPGDRECQLGPR119EPHX1PTPN2
SCHEMBL21458682 0.84 HPGD (0.46) HPGDRECQLGPR119EPHX1PTPN2
SCHEMBL30869902 0.84 HPGD (0.46) HPGDRECQLGPR119EPHX1PTPN2
SCHEMBL16302472 0.84 HPGD (0.46) HPGDRECQLGPR119EPHX1PTPN2
SCHEMBL21458709 0.84 HPGD (0.46) HPGDRECQLGPR119EPHX1PTPN2
SCHEMBL15362664 0.84 HPGD (0.46) HPGDRECQLGPR119EPHX1PTPN2

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-2023125806-A1 CONJUGATE FOR PREVENTING AND TREATING VIRAL INFECTIONS AND USE THEREOF 苏州爱科百发生物医药技术有限公司 2023-07-06 WO disclosed