SCHEMBL22876028

SCHEMBL22876028

CC(CCO)C(=O)NCCCCC(N)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DPP7 Q9UHL4 2/20 0.49
▸ GNAI3 P08754 1/20 0.47
▸ GNAO1 P09471 1/20 0.47
▸ GNAI1 P63096 1/20 0.47
▸ NOD1 Q9Y239 1/20 0.45
▸ GSR P00390 1/20 0.44
▸ OTC P00480 1/20 0.44
▸ RRM1 P23921 1/20 0.42
▸ ARG2 P78540 4/20 0.41
▸ ARG1 P05089 3/20 0.41
▸ NOS2 P35228 4/20 0.41
▸ NOS1 P29475 3/20 0.41
▸ NOS3 P29474 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ BLM P54132 1/20 0.40

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
SCHEMBL14000511 0.86 DPP7 (0.64) DPP7GNAI3GNAO1GNAI1NOD1
SCHEMBL21666885 0.86 DPP7 (0.54) DPP7GNAI3GNAO1GNAI1NOD1
SCHEMBL20100208 0.86 DPP7 (0.54) DPP7GNAI3GNAO1GNAI1NOD1
SCHEMBL19992546 0.84 DPP7 (0.49) DPP7GNAI3GNAO1GNAI1NOD1
SCHEMBL20006611 0.83 DPP7 (0.54) DPP7GNAI3GNAO1GNAI1NOD1
SCHEMBL17451629 0.83 DPP7 (0.54) DPP7GNAI3GNAO1GNAI1NOD1
SCHEMBL20085606 0.83 DPP7 (0.54) DPP7GNAI3GNAO1GNAI1NOD1
SCHEMBL19738538 0.82 DPP7 (0.53) DPP7GNAI3GNAO1GNAI1NOD1
SCHEMBL5666448 0.82 DPP7 (0.53) DPP7GNAI3GNAO1GNAI1NOD1
SCHEMBL18746115 0.82 DPP7 (0.46) DPP7GNAI3GNAO1GNAI1NOD1

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-2021007433-A1 PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR AND THEIR USE TO TREAT INFLAMMATORY DISEASES PROTAGONIST THERAPEUTICS, INC. (US) 2021-01-14 — — WO disclosed
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