SCHEMBL13760097

SCHEMBL13760097

CN[C@H](Cc1ccc2ccccc2c1)C(=O)N(C)C(C(=O)N1CCC[C@@H](CN(C)C)C1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 14/20 0.40
F10 P00742 1/20 0.40
OPRD1 P41143 1/20 0.39
F2 P00734 2/20 0.39
PLAU P00749 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
SCHEMBL1401107 0.89 TACR1 (0.42) TACR1F10F2PLAU
SCHEMBL1401110 0.89 TACR1 (0.42) TACR1F10F2PLAU
SCHEMBL12188654 0.83 TACR1 (0.40) TACR1F10PLAU
SCHEMBL12240870 0.80 GHSR (0.39) TACR1F10OPRD1PLAU
SCHEMBL1401188 0.80 OPRD1 (0.44) TACR1F10OPRD1F2PLAU
SCHEMBL12188653 0.80 GHSR (0.51) TACR1OPRD1
SCHEMBL1401201 0.79 HPGD (0.47)
SCHEMBL7897790 0.79 HPGD (0.47)
SCHEMBL1401204 0.79 HPGD (0.47)
SCHEMBL1401075 0.75 TACR1 (0.47) TACR1

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
US-7576062-B2 Administering a patient an effective amount of (2E)-4-(1-Aminocyclobutyl)but-2-enoic acid N-((1R)-1-{N-[(1R)-1-benzyl-2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]-N-methylcarbamoyl}-2-(biphenyl-4-yl)ethyl)-N-methylamide; treat the medical disorders resulting from a deficiency in growth hormone NOVO NORDISK A/S (DK) 2009-08-18 US disclosed