SCHEMBL30750751

SCHEMBL30750751

CC(C)(C)OC(=O)N1CCC(OCCCCCOCCO)CC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.44
HPGD P15428 1/20 0.44
RECQL P46063 1/20 0.42
EPHX1 P07099 1/20 0.42
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
ALDH1A1 P00352 1/20 0.40
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL20133352 0.93 HPGD (0.45) GPR119HPGDRECQLEPHX1PRMT5
SCHEMBL30750499 0.93 HPGD (0.45) GPR119HPGDRECQLEPHX1PRMT5
SCHEMBL16302472 0.92 HPGD (0.46) GPR119HPGDRECQLEPHX1PRMT5
SCHEMBL21458682 0.92 HPGD (0.46) GPR119HPGDRECQLEPHX1PRMT5
SCHEMBL21458709 0.92 HPGD (0.46) GPR119HPGDRECQLEPHX1PRMT5
SCHEMBL30869902 0.92 HPGD (0.46) GPR119HPGDRECQLEPHX1PRMT5
SCHEMBL13096783 0.91 HPGD (0.47) GPR119HPGDRECQLEPHX1PRMT5
SCHEMBL4219721 0.89 HPGD (0.48) GPR119HPGDRECQLEPHX1PRMT5
SCHEMBL1576027 0.89 HPGD (0.50) GPR119HPGDRECQLEPHX1PRMT5
SCHEMBL30750642 0.88 GPR119 (0.43) GPR119HPGDRECQLEPHX1PRMT5

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-2024054954-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE HALDA THERAPEUTICS OPCO, INC. (US) 2024-03-14 WO disclosed