SCHEMBL23735536

SCHEMBL23735536

COC(=O)NCCCNC(=O)NCCCNC(=O)OC

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.61
ACHE P22303 8/20 0.45
PRMT1 Q99873 1/20 0.43
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
EPHX2 P34913 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
SCHEMBL23735538 0.95 EPHX1 (0.68) EPHX1ACHEPRMT1MEN1KMT2A
SCHEMBL23735485 0.93 EPHX1 (0.72) EPHX1ACHEPRMT1EPHX2
SCHEMBL14433357 0.92 EPHX1 (0.70) EPHX1ACHEMEN1GAAKMT2A
SCHEMBL7252127 0.87 EPHX1 (0.77) EPHX1ACHEMEN1KMT2A
SCHEMBL23735539 0.87 EPHX1 (0.59) EPHX1ACHEPRMT1EPHX2
SCHEMBL7788927 0.84 EPHX1 (0.82) EPHX1ACHEMEN1KMT2A
SCHEMBL14252129 0.84 EPHX1 (0.82) EPHX1ACHEMEN1KMT2A
SCHEMBL7788937 0.84 EPHX1 (0.82) EPHX1ACHEMEN1KMT2A
SCHEMBL7788569 0.84 EPHX1 (0.82) EPHX1ACHEMEN1KMT2A
SCHEMBL717081 0.84 EPHX1 (0.82) EPHX1ACHEMEN1KMT2A

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-3157978-B1 STRICTLY SEGMENTED THERMOPLASTIC ELASTOMERS AS BIODEGRADABLE BIOMATERIALS SYMO CHEM B V (NL) 2021-08-11 EP disclosed