SCHEMBL6657445

SCHEMBL6657445

CN[C@H](Cc1ccc2ccccc2c1)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)N(C)CCc1ccccn1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 7/20 0.52
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
PTGFR P43088 1/20 0.40
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 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
SCHEMBL7771304 1.00 GHSR (0.52) GHSRALDH1A1KDM4EMMP9MMP8
SCHEMBL8170611 0.85 GHSR (0.54) GHSRMMP9MMP8
SCHEMBL5879498 0.84 ALDH1A1 (0.50) ALDH1A1KDM4EPTGFRKMT2ANPC1
SCHEMBL6656758 0.84 ALDH1A1 (0.50) ALDH1A1KDM4EPTGFRKMT2ANPC1
SCHEMBL5879436 0.84 ALDH1A1 (0.50) ALDH1A1KDM4EPTGFRKMT2ANPC1
SCHEMBL6661365 0.84 GHSR (0.50) GHSRALDH1A1KDM4EPTGFRKMT2A
SCHEMBL8710705 0.83 GHSR (0.52) GHSRMMP9MMP8
SCHEMBL6320694 0.82 MMP9 (0.56) GHSRMMP9MMP8
SCHEMBL8235025 0.81 GHSR (0.49) GHSRMMP9MMP8
SCHEMBL3266844 0.80 GHSR (0.48) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1127071-B1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2004-08-04 EP claimed
EP-1127071-B1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2004-08-04 EP disclosed
US-6566337-B1 Compounds with growth hormone releasing properties NOVO NORDISK A/S (DK) 2003-05-20 US disclosed
EP-1127071-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES Novo Nordisk A/S (DK) 2001-08-29 EP disclosed
WO-2000026252-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 2000-05-11 WO disclosed