SCHEMBL25925311

SCHEMBL25925311

CCC(=O)NCCC1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MTNR1A P48039 12/20 0.42
MTNR1B P49286 12/20 0.42
ALDH1A1 P00352 1/20 0.41
ABCB11 O95342 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
USP2 O75604 1/20 0.41
NQO2 P16083 4/20 0.40
NAMPT P43490 1/20 0.39
PRMT3 O60678 1/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
PKM P14618 1/20 0.38
EPHX1 P07099 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
SCHEMBL22169791 0.90 MEN1 (0.42) MEN1KMT2AMTNR1AMTNR1BABCB11
SCHEMBL5383679 0.87 MEN1 (0.54) MEN1KMT2AMTNR1AMTNR1BABCB11
SCHEMBL13070014 0.84 ALDH1A1 (0.42) ALDH1A1NAMPTPRMT3EPHX1
SCHEMBL15759098 0.83 ALDH1A1 (0.47) MEN1KMT2AMTNR1AMTNR1BALDH1A1
SCHEMBL931401 0.81 EPHX1 (0.56) MEN1KMT2AMTNR1AMTNR1BALDH1A1
SCHEMBL9893063 0.81 BRD4 (0.43) MTNR1AMTNR1BALDH1A1NQO2NAMPT
SCHEMBL9893127 0.81 EPHX1 (0.56) MEN1KMT2AMTNR1AMTNR1BALDH1A1
SCHEMBL14321920 0.81 NPC1 (0.42) MEN1KMT2AMTNR1AMTNR1BALDH1A1
SCHEMBL15248911 0.80 NAMPT (0.40) ALDH1A1NAMPTPRMT3POLBEPHX1
SCHEMBL6119947 0.79 NAMPT (0.41) ALDH1A1NAMPTPRMT3EPHX1

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
EP-4219502-A1 IMIDAZO[1,5-A]PYRAZINE DERIVATIVES AS PI3KDELTA INHIBITORS BeiGene, Ltd. (KY) 2023-08-02 EP disclosed