SCHEMBL28328772

SCHEMBL28328772

CCCCCCCCCNC(=O)C(C)CCCC

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.62
RRM1 P23921 1/20 0.57
EPHX1 P07099 9/20 0.55
GNAI3 P08754 1/20 0.54
GNAO1 P09471 1/20 0.54
GNAI1 P63096 1/20 0.54
MMP8 P22894 1/20 0.54
CNR1 P21554 1/20 0.51
CASP2 P42575 1/20 0.50
FNTA P49354 1/20 0.50
FNTB P49356 1/20 0.50

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
SCHEMBL21467378 0.98 DPP7 (0.65) DPP7RRM1EPHX1GNAI3GNAO1
SCHEMBL28285001 0.96 GNAI3 (0.58) DPP7RRM1EPHX1GNAI3GNAO1
SCHEMBL28052266 0.96 GNAI3 (0.58) DPP7RRM1EPHX1GNAI3GNAO1
SCHEMBL28100557 0.96 GNAI3 (0.58) DPP7RRM1EPHX1GNAI3GNAO1
SCHEMBL14874696 0.96 GNAI3 (0.58) DPP7RRM1EPHX1GNAI3GNAO1
SCHEMBL28052076 0.96 GNAI3 (0.58) DPP7RRM1EPHX1GNAI3GNAO1
SCHEMBL24072535 0.92 DPP7 (0.58) DPP7RRM1EPHX1GNAI3GNAO1
SCHEMBL11181600 0.92 GNAI3 (0.54) DPP7RRM1EPHX1GNAI3GNAO1
SCHEMBL14138765 0.92 DPP7 (0.58) DPP7RRM1EPHX1GNAI3GNAO1
SCHEMBL23430583 0.92 DPP7 (0.58) DPP7RRM1EPHX1GNAI3GNAO1

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
CN-110312702-A Particularly for the asymmetric N of SEPARATION OF URANIUM (VI) and plutonium (IV), N- dialkyl amide, synthesis and purposes 原子能和替代能源委员会 2019-10-08 CN disclosed