SCHEMBL2068541

SCHEMBL2068541

CC(N)C(=O)NCC(=O)NC(C)C(=O)NCC(=O)NC(CCCCN)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 1/20 0.47
▸ FOLH1 Q04609 1/20 0.45
▸ NOD1 Q9Y239 1/20 0.44
▸ CPB2 Q96IY4 7/20 0.42
▸ ERAP2 Q6P179 1/20 0.41
▸ ERAP1 Q9NZ08 1/20 0.41
▸ LNPEP Q9UIQ6 1/20 0.41
▸ NMT2 O60551 1/20 0.40
▸ NMT1 P30419 1/20 0.40
▸ SLC15A2 Q16348 1/20 0.39
▸ OPRD1 P41143 4/20 0.39
▸ OPRM1 P35372 3/20 0.39
▸ OPRK1 P41145 1/20 0.39

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
SCHEMBL2068543 1.00 SLC6A5 (0.47) SLC6A5FOLH1NOD1CPB2ERAP2
SCHEMBL8540023 0.95 SLC6A5 (0.51) SLC6A5FOLH1NOD1CPB2ERAP2
SCHEMBL8540018 0.95 SLC6A5 (0.51) SLC6A5FOLH1NOD1CPB2ERAP2
SCHEMBL30880423 0.86 GNAI3 (0.45) SLC6A5FOLH1NOD1CPB2ERAP2
SCHEMBL29453813 0.86 NOD1 (0.42) SLC6A5FOLH1NOD1CPB2
SCHEMBL847122 0.85 GNAI3 (0.44) SLC6A5FOLH1NOD1CPB2ERAP2
SCHEMBL30753565 0.85 NMT1 (0.54) SLC6A5FOLH1NOD1CPB2ERAP2
SCHEMBL847121 0.85 GNAI3 (0.44) SLC6A5FOLH1NOD1CPB2ERAP2
SCHEMBL29674782 0.84 SLC6A5 (0.69) SLC6A5NOD1NMT2NMT1
SCHEMBL29429304 0.84 SLC6A5 (0.69) SLC6A5NOD1NMT2NMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9733241-B2 Detection of degradative enzymes and biomolecules in bodily fluids THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-08-15 — — US disclosed
US-20160169885-A1 DETECTION OF DEGRADATIVE ENZYMES AND BIOMOLECULES IN BODILY FLUIDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-06-16 — — US disclosed
US-9222119-B2 Detection of degradative enzymes and biomolecules in bodily fluids THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-12-29 — — US disclosed
US-20150094449-A1 DETECTION OF DEGRADATIVE ENZYMES AND BIOMOLECULES IN BODILY FLUIDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-04-02 — — US disclosed
US-8940866-B2 Detection of degradative enzymes and biomolecules in bodily fluids THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-01-27 — — US disclosed
US-20130281660-A1 DETECTION OF DEGRADATIVE ANZYMES AND BIOMOLECULES IN BODILY FLUIDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2013-10-24 — — US disclosed
US-8507218-B2 Detection of degradative enzymes in bodily fluids THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-08-13 — — US disclosed
US-20110065127-A1 Detection of Degradative Enzymes and Biomolecules in Bodily Fluids The Regents of the University of California a Cali fornia corporation (US) 2011-03-17 — — US disclosed
WO-2009100447-A2 DETECTION OF DEGRADATIVE ENZYMES AND BIOMOLECULES IN BODILY FLUIDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-08-13 — — WO disclosed
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