SCHEMBL9150255

SCHEMBL9150255

CCCCCCCCCCCCNC(=O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(=O)NCCCCCCCCCCCC

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.57
DPP7 Q9UHL4 2/20 0.55
RRM1 P23921 1/20 0.54
NAAA Q02083 2/20 0.54
METAP2 P50579 1/20 0.54
CASP2 P42575 1/20 0.52
GNAI3 P08754 1/20 0.51
GNAO1 P09471 1/20 0.51
GNAI1 P63096 1/20 0.51
MMP8 P22894 1/20 0.51
FNTA P49354 1/20 0.51
FNTB P49356 1/20 0.51
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48

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
SCHEMBL9154760 1.00 EPHX1 (0.57) EPHX1DPP7RRM1NAAAMETAP2
SCHEMBL22618594 1.00 EPHX1 (0.57) EPHX1DPP7RRM1NAAAMETAP2
SCHEMBL12354358 0.98 DPP7 (0.56) EPHX1DPP7RRM1NAAAMETAP2
SCHEMBL20876016 0.93 FNTA (0.54) EPHX1DPP7RRM1NAAAMETAP2
SCHEMBL20875842 0.93 FNTA (0.54) EPHX1DPP7RRM1NAAAMETAP2
SCHEMBL20875784 0.93 FNTA (0.54) EPHX1DPP7RRM1NAAAMETAP2
SCHEMBL20875783 0.93 FNTA (0.54) EPHX1DPP7RRM1NAAAMETAP2
SCHEMBL20875806 0.93 FNTA (0.54) EPHX1DPP7RRM1NAAAMETAP2
SCHEMBL20875750 0.93 FNTA (0.54) EPHX1DPP7RRM1NAAAMETAP2
SCHEMBL20875838 0.93 FNTA (0.54) EPHX1DPP7RRM1NAAAMETAP2

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
US-5478374-A Carbohydrate acid amide plant fertilizers KIELY DONALD E (US) 1995-12-26 US disclosed