SCHEMBL29461567

SCHEMBL29461567

CCCCCCCCCCCCCCCCNC(=O)[C@@H](N)C(C)C

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 3/20 0.61
RRM1 P23921 1/20 0.60
GNAI3 P08754 1/20 0.57
GNAO1 P09471 1/20 0.57
GNAI1 P63096 1/20 0.57
EPHX1 P07099 8/20 0.53
MMP8 P22894 1/20 0.53
S1PR2 O95136 2/20 0.53
S1PR1 P21453 2/20 0.53
S1PR3 Q99500 2/20 0.53
S1PR5 Q9H228 1/20 0.53
DPP4 P27487 1/20 0.49
DPP8 Q6V1X1 1/20 0.49
DPP9 Q86TI2 1/20 0.49
FNTA P49354 1/20 0.49
FNTB P49356 1/20 0.49
CASP2 P42575 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
SCHEMBL7715546 1.00 DPP7 (0.61) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL18171394 1.00 DPP7 (0.61) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL27874767 1.00 DPP7 (0.61) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL7715038 1.00 DPP7 (0.61) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL12555476 1.00 DPP7 (0.61) DPP7RRM1GNAI3GNAO1GNAI1
Hydrochloric Acid SCHEMBL7769031 0.98 DPP7 (0.59) DPP7RRM1GNAI3GNAO1GNAI1
Hydrochloric Acid SCHEMBL7769083 0.98 DPP7 (0.59) DPP7RRM1GNAI3GNAO1GNAI1
Hydrochloric Acid SCHEMBL7770691 0.98 DPP7 (0.59) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL26352049 0.98 DPP7 (0.62) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL6129730 0.92 DPP7 (0.55) 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
CN-110479119-B Preparation method of polyamide composite reverse osmosis membrane 武汉纺织大学 2022-03-25 CN disclosed