SCHEMBL4585800

SCHEMBL4585800

CCCCCCCCCNC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 8/20 0.56
SMN1; SMN2 Q16637 1/20 0.55
EPHX2 P34913 7/20 0.46
ASAH2 Q9NR71 1/20 0.45
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
FAAH O00519 1/20 0.42

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
SCHEMBL4585179 1.00 EPHX1 (0.56) EPHX1SMN1; SMN2EPHX2ASAH2FNTA
SCHEMBL4585168 1.00 EPHX1 (0.56) EPHX1SMN1; SMN2EPHX2ASAH2FNTA
SCHEMBL4586041 0.85 EPHX1 (0.63) EPHX1SMN1; SMN2FNTAFNTBFAAH
SCHEMBL4585957 0.85 EPHX1 (0.63) EPHX1SMN1; SMN2FNTAFNTBFAAH
SCHEMBL14064432 0.85 EPHX1 (0.63) EPHX1SMN1; SMN2FNTAFNTBFAAH
SCHEMBL21724268 0.85 EPHX1 (0.52) EPHX1SMN1; SMN2EPHX2
SCHEMBL21724650 0.85 EPHX1 (0.52) EPHX1SMN1; SMN2EPHX2
SCHEMBL21724271 0.85 EPHX1 (0.52) EPHX1SMN1; SMN2EPHX2
SCHEMBL21724646 0.85 EPHX1 (0.52) EPHX1SMN1; SMN2EPHX2
SCHEMBL7769494 0.85 EPHX1 (0.71) EPHX1SMN1; SMN2FAAH

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008113992-A2 GEL COMPOSITIONS COMPRISING UREA DERIVATIVES PLIVA HRVATSKA D.O.O. (HR) 2008-09-25 WO claimed
WO-2008113992-A2 GEL COMPOSITIONS COMPRISING UREA DERIVATIVES PLIVA HRVATSKA D.O.O. (HR) 2008-09-25 WO disclosed
WO-2008113992-A2 GEL COMPOSITIONS COMPRISING UREA DERIVATIVES PLIVA HRVATSKA D.O.O. (HR) 2008-09-25 WO disclosed