SCHEMBL1976979

SCHEMBL1976979

CCCCCCCCCCCCNC(=O)[C@@H](N)CC(=O)O

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.67
RRM1 P23921 1/20 0.66
GNAI3 P08754 1/20 0.62
GNAO1 P09471 1/20 0.62
GNAI1 P63096 1/20 0.62
S1PR1 P21453 7/20 0.57
S1PR3 Q99500 7/20 0.57
S1PR2 O95136 5/20 0.57
S1PR5 Q9H228 4/20 0.57
NOD1 Q9Y239 1/20 0.51
EPHX1 P07099 5/20 0.50
FNTA P49354 1/20 0.50
FNTB P49356 1/20 0.50
NAAA Q02083 2/20 0.49

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
SCHEMBL27183085 1.00 DPP7 (0.67) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL1977809 1.00 DPP7 (0.67) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL7769958 1.00 DPP7 (0.67) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL31157642 1.00 DPP7 (0.67) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL7770773 1.00 DPP7 (0.67) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL7769954 1.00 DPP7 (0.67) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL3876752 1.00 DPP7 (0.67) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL16124665 1.00 DPP7 (0.67) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL1978591 1.00 DPP7 (0.67) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL16124667 0.98 DPP7 (0.69) DPP7RRM1GNAI3GNAO1GNAI1

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-2011070436-A2 IN SITU CROSS LINKED BIODEGRADABLE GEL WITH HYDROPHOBIC POCKETS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2011-06-16 WO disclosed