SCHEMBL22018338

SCHEMBL22018338

CCCNCC(=O)NCC(=O)NCC

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.42
PAOX Q6QHF9 1/20 0.41
GAA P10253 1/20 0.39
MCL1 Q07820 2/20 0.39
KMT2A Q03164 2/20 0.35
DPP4 P27487 1/20 0.35
MMP1 P03956 2/20 0.34
MMP2 P08253 2/20 0.34
MMP3 P08254 2/20 0.34
MMP9 P14780 2/20 0.34
MEN1 O00255 1/20 0.33
EPHX1 P07099 1/20 0.33
CTSD P07339 1/20 0.33
CNR1 P21554 1/20 0.33
CASP2 P42575 1/20 0.32
MMP8 P22894 1/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL12268125 0.96 FAAH (0.45) FAAHPAOXGAAMCL1KMT2A
SCHEMBL1380471 0.84 MCL1 (0.50) PAOXGAAMCL1KMT2ADPP4
SCHEMBL21153346 0.84 MCL1 (0.48) FAAHGAAMCL1KMT2ADPP4
SCHEMBL17663629 0.83 GAA (0.49) FAAHPAOXGAAKMT2AMMP2
SCHEMBL28528638 0.83 GAA (0.56) FAAHPAOXGAAMCL1KMT2A
SCHEMBL1330451 0.83 FAAH (0.42) FAAHPAOXGAAMCL1KMT2A
SCHEMBL25920484 0.81 MAOA (0.39) PAOXGAAMCL1KMT2ADPP4
SCHEMBL8429840 0.80 MCL1 (0.40) FAAHGAAMCL1KMT2AMEN1
SCHEMBL1790228 0.79
SCHEMBL9192136 0.78 MCL1 (0.39) FAAHGAAMCL1KMT2AMMP1

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-2020099925-A2 PEPTIDES AND PHARMACEUTICAL COMPOSITIONS FOR TREATING EYE DISEASES YUYU PHARMA, INC. (KR) 2020-05-22 WO disclosed