Sugi Predict

Sugi Predict / Compounds / SCHEMBL28628859

SCHEMBL28628859

SCHEMBL28628859

CCCCCCCCCCCCNC(=O)OC(=O)N1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 6/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ EPHX2 P34913 1/20 0.45
▸ ACHE P22303 6/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ NAAA Q02083 1/20 0.43

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
SCHEMBL28640721 1.00 EPHX1 (0.54) EPHX1L3MBTL1KDM4EEPHX2ACHE
SCHEMBL28625498 1.00 EPHX1 (0.54) EPHX1L3MBTL1KDM4EEPHX2ACHE
SCHEMBL8393260 0.78 HTT (0.60) EPHX1L3MBTL1KDM4EMEN1KMT2A
SCHEMBL8395941 0.78 HTT (0.60) EPHX1L3MBTL1KDM4EMEN1KMT2A
SCHEMBL8391321 0.78 HTT (0.60) EPHX1L3MBTL1KDM4EMEN1KMT2A
SCHEMBL3885999 0.78 EPHX1 (0.44) EPHX1L3MBTL1MEN1KMT2ATDP1
SCHEMBL8394588 0.77 HTT (0.58) EPHX1L3MBTL1KDM4EEPHX2MEN1
SCHEMBL7692009 0.77 HTT (0.58) EPHX1L3MBTL1KDM4EEPHX2MEN1
SCHEMBL8396793 0.77 HTT (0.58) EPHX1L3MBTL1KDM4EEPHX2MEN1
SCHEMBL8397091 0.76 HTT (0.62) EPHX1L3MBTL1KDM4EMEN1KMT2A

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-109641878-B DIPROVOCIM: effective TLR agonist 斯克里普斯研究学院 2021-09-14 — — CN disclosed