SCHEMBL25510639

SCHEMBL25510639

CCCCCNC(=O)NC1CC1

nearest known ligand 0.83

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 17/20 0.83
EPHX2 P34913 3/20 0.81
KDM4E B2RXH2 1/20 0.62
ALDH1A1 P00352 1/20 0.62

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
SCHEMBL15263125 0.94 EPHX1 (0.74) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL15515250 0.94 EPHX1 (0.74) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL1753631 0.93 EPHX1 (0.97) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL24976934 0.92 EPHX1 (0.77) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL6510701 0.92 EPHX1 (0.71) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL12196044 0.91 EPHX1 (1.00) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL7440101 0.91 EPHX1 (1.00) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL2753457 0.91 EPHX1 (0.97) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL3817173 0.91 EPHX1 (0.97) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL2752706 0.91 EPHX1 (0.97) EPHX1EPHX2KDM4EALDH1A1

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-2023083365-A1 PAD4 INHIBITORS AND USE THEREOF QILU REGOR THERAPEUTICS INC. (CN) 2023-05-19 WO disclosed