SCHEMBL8169728

SCHEMBL8169728

CNCc1cccc(C(=O)N(C)[C@H](Cc2ccc3ccccc3c2)C(=O)N(C)[C@H](Cc2ccccc2)C(=O)N(C)CCN(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 7/20 0.48
PARP1 P09874 2/20 0.39
TACR1 P25103 2/20 0.39
MRGPRX4 Q96LA9 1/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
PPARG P37231 1/20 0.36
UTS2R Q9UKP6 1/20 0.36
MME P08473 1/20 0.36

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
SCHEMBL8170501 0.89 GHSR (0.46) GHSRPARP1TACR1
SCHEMBL3270951 0.87 GHSR (0.42) GHSRTACR1MRGPRX4MMP9MMP8
SCHEMBL8190770 0.85 GHSR (0.44) GHSRUTS2R
SCHEMBL8169710 0.85 GHSR (0.44) GHSRUTS2R
SCHEMBL13307621 0.84 GHSR (0.44) GHSRTACR1MRGPRX4MMP9MMP8
SCHEMBL8170611 0.81 GHSR (0.54) GHSRTACR1MMP9MMP8UTS2R
SCHEMBL3266614 0.80 PPARG (0.41) GHSRTACR1MRGPRX4MMP9MMP8
SCHEMBL8169389 0.80 GHSR (0.43) GHSR
SCHEMBL1401182 0.80 TACR1 (0.44) TACR1
SCHEMBL29958711 0.79 F2 (0.44) GHSRMMP9MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6127341-A AMINOMETHYL-N-(1-((2-(2-THIENYL)-1-(1-CARBAMOYL-5 -AMINOPENTYLCARBAMOYL)ETHYL)-N-METHYLCARBAMOYL)-2-(2 -NAPTHYL)ETHYL)BENZAMIDE, FOR EXAMPLE; ADMINISTERING TO STIMULATE GROWTH, MILK OR WOOL PRODUCTION IN ANIMALS NOVO NORDISK A/S (DK) 2000-10-03 US claimed
EP-1005484-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 2000-06-07 EP claimed
WO-1998058950-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1998-12-30 WO claimed
US-6127341-A AMINOMETHYL-N-(1-((2-(2-THIENYL)-1-(1-CARBAMOYL-5 -AMINOPENTYLCARBAMOYL)ETHYL)-N-METHYLCARBAMOYL)-2-(2 -NAPTHYL)ETHYL)BENZAMIDE, FOR EXAMPLE; ADMINISTERING TO STIMULATE GROWTH, MILK OR WOOL PRODUCTION IN ANIMALS NOVO NORDISK A/S (DK) 2000-10-03 US disclosed
EP-1005484-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 2000-06-07 EP disclosed
WO-1998058950-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1998-12-30 WO disclosed