SCHEMBL6602216

SCHEMBL6602216

NC(=O)c1nc([C@H](N)Cc2ccc3ccccc3c2)sc1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.42
ACE P12821 2/20 0.42
CPA1 P15085 2/20 0.42
ACE2 Q9BYF1 2/20 0.42
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
DPP4 P27487 1/20 0.39
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
TNIK Q9UKE5 3/20 0.39
SLC7A11 Q9UPY5 1/20 0.39
FCER2 P06734 1/20 0.39
PIN1 Q13526 2/20 0.38
CA2 P00918 1/20 0.38
CTSC P53634 1/20 0.37

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
SCHEMBL27493870 1.00 MME (0.42) MMEACECPA1ACE2SLC1A3
SCHEMBL6600260 0.84 CTSC (0.45) MMEACECPA1ACE2DPP4
SCHEMBL27494688 0.84 CTSC (0.45) MMEACECPA1ACE2DPP4
SCHEMBL27552033 0.79 CTSS (0.52)
SCHEMBL6600308 0.79 CTSS (0.52)
SCHEMBL6599351 0.75 CTSS (0.56)
SCHEMBL6600113 0.74 PTPN1 (0.36) MMEACECPA1ACE2MC5R
SCHEMBL27478624 0.70 CTSS (0.53)
SCHEMBL4575102 0.67 HTR2A (0.59) SLC1A3SLC1A2SLC1A1HTR2AHTR2C
SCHEMBL93303 0.67 SLC7A5 (0.65) SLC1A3SLC1A2SLC1A1HTR2AHTR2C

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
CN-1225471-C Compounds with growth hormone releasing properties NOVO NORDISK AS (DK) 2005-11-02 CN disclosed
EP-0805816-B1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2004-07-28 EP disclosed
US-6350767-B1 GROWTH HORMONE RELEASE STIMULANT NOVO NORDISK A/S (DK) 2002-02-26 US disclosed
US-6013658-A ANIMAL GROWTH REGULATORS NOVO NORDISK A/S (DK) 2000-01-11 US disclosed
CN-1176645-A Compounds with growth hormone releasing properties NOVO NORDISK AS (DK) 1998-03-18 CN disclosed
WO-1996022997-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1996-08-01 WO disclosed