SCHEMBL4382952

SCHEMBL4382952

CCOC(=O)OC1(Cc2ccccc2)CCN(C(=O)[C@@H](Cc2ccc3ccccc3c2)N(C)C(=O)/C=C(\C)CC(C)(C)N)CC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.38
GHSR Q92847 6/20 0.37
DPP4 P27487 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
P2RX7 Q99572 1/20 0.33
PLG P00747 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
ADORA1 P30542 1/20 0.32
F2 P00734 1/20 0.32

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
SCHEMBL4375272 0.91 GHSR (0.35) OPRD1GHSRDPP4MEN1KMT2A
SCHEMBL4385374 0.90 GHSR (0.40) OPRD1GHSRDPP4
SCHEMBL4369742 0.89 GHSR (0.48) OPRD1GHSRDPP4MEN1KMT2A
SCHEMBL868238 0.89 MEN1 (0.43) OPRD1GHSRMEN1KMT2ANPC1
SCHEMBL868237 0.89 MEN1 (0.43) OPRD1GHSRMEN1KMT2ANPC1
SCHEMBL7860577 0.89 MEN1 (0.43) OPRD1GHSRMEN1KMT2ANPC1
SCHEMBL4372106 0.83 GHSR (0.42) OPRD1GHSRDPP4
SCHEMBL868448 0.83 GHSR (0.42) OPRD1GHSRDPP4
SCHEMBL4372111 0.83 GHSR (0.42) OPRD1GHSRDPP4
SCHEMBL4369760 0.80 GHSR (0.48) GHSRDPP4P2RX7ADORA1

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
EP-1077941-B1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2009-08-12 EP claimed