SCHEMBL4634385

SCHEMBL4634385

N[C@@H](Cc1ccc2ccccc2c1)C(=O)NCC(O)CNC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NLN Q9BYT8 1/20 0.49
DPP4 P27487 1/20 0.47
MC4R P32245 2/20 0.47
MC5R P33032 2/20 0.47
MC3R P41968 2/20 0.47
OPRD1 P41143 1/20 0.46
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
HTR2B P41595 1/20 0.44
CTSC P53634 1/20 0.44
FCER2 P06734 1/20 0.43
MMP2 P08253 2/20 0.43
MME P08473 1/20 0.42
ACE P12821 1/20 0.42
CPA1 P15085 1/20 0.42
ACE2 Q9BYF1 1/20 0.42

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
SCHEMBL5125544 0.84 NLN (0.50) NLNDPP4MC4RMC5RMC3R
SCHEMBL5125551 0.84 NLN (0.50) NLNDPP4MC4RMC5RMC3R
SCHEMBL30104067 0.82 OPRD1 (0.54) NLNDPP4MC4RMC5RMC3R
SCHEMBL5556817 0.82 NLN (0.62) NLNDPP4MC4RMC5RMC3R
SCHEMBL6019536 0.80 CTSS (0.61) NLNDPP4OPRD1HTR2AHTR2C
SCHEMBL5558741 0.80 CA12 (0.52) NLNDPP4MC4RMC5RMC3R
SCHEMBL1769595 0.79 NLN (0.50) NLNDPP4OPRD1HTR2AHTR2C
SCHEMBL1769590 0.79 NLN (0.50) NLNDPP4OPRD1HTR2AHTR2C
SCHEMBL12520303 0.79 NLN (0.50) NLNDPP4OPRD1HTR2AHTR2C
SCHEMBL24455558 0.78 CSK (0.55) NLNDPP4OPRD1HTR2AHTR2C

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
EP-1930021-A2 Novel amide derivatives as growth hormone secretagogues Kaken Pharmaceutical Co., Ltd. (JP) 2008-06-11 EP disclosed
US-7022677-B1 Amide derivatives as growth hormone secretagogues KAKEN PHARMACEUTICAL CO., LTD. (JP) 2006-04-04 US disclosed
US-20060014701-A1 Novel amide derivatives as growth hormone secretagogues KAKEN PHARMACEUTICAL CO., LTD. (JP) 2006-01-19 US disclosed
EP-1158996-A4 NOVEL AMIDE DERIVATIVES AS GROWTH HORMONE SECRETAGOGUES KAKEN PHARMA CO LTD (JP) 2005-01-12 EP disclosed
EP-1158996-A1 NOVEL AMIDE DERIVATIVES AS GROWTH HORMONE SECRETAGOGUES Kaken Pharmaceutical Co., Ltd. (JP) 2001-12-05 EP disclosed
WO-2000048623-A1 NOVEL AMIDE DERIVATIVES AS GROWTH HORMONE SECRETAGOGUES KAKEN PHARMACEUTICAL CO., LTD. (JP) 2000-08-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060014701-A1 Novel amide derivatives as growth hormone secretagogues GHSR, GHRHR, SSTR1 NLN 3610/4885DPP4 1489/4885MC4R 137/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.