SCHEMBL5834854

SCHEMBL5834854

CCN(CC)c1ccc(NC(=O)C2(NC(=O)OCc3ccccc3)CCc3ccccc3C2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 5/20 0.77
NOX1 Q9Y5S8 2/20 0.47
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
CTSS P25774 1/20 0.43
KCNH2 Q12809 1/20 0.42
NPY1R P25929 1/20 0.42
NPY2R P49146 1/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TP53 P04637 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 2/20 0.40

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
SCHEMBL5835222 0.90 GHSR (0.69) GHSRNOX1KCNH2NPY1RNPY2R
SCHEMBL5834765 0.90 GHSR (0.69) GHSRNOX1KCNH2NPY1RNPY2R
SCHEMBL5834796 0.90 GHSR (0.82) GHSRNOX1KCNH2NPY1RNPY2R
SCHEMBL5835377 0.89 GHSR (0.79) GHSRNOX1KCNH2NPY1RNPY2R
SCHEMBL5835606 0.87 GHSR (0.77) GHSRNOX1KCNH2NPC1RAB9A
SCHEMBL5835307 0.87 GHSR (0.77) GHSRNOX1KCNH2NPY1RNPY2R
SCHEMBL5835251 0.87 GHSR (0.77) GHSRNOX1KCNH2NPY1RNPY2R
SCHEMBL5835098 0.87 GHSR (0.77) GHSRNOX1KCNH2NPY1RNPY2R
SCHEMBL5835194 0.87 GHSR (0.77) GHSRNOX1KCNH2NPC1RAB9A
SCHEMBL5835538 0.87 GHSR (0.77) GHSRNOX1KCNH2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7115767-B2 Tetraline derivatives as ghrelin receptor modulators ABBOTT LABORATORIES (US) 2006-10-03 US claimed
US-20050014794-A1 Tetraline derivatives as ghrelin receptor modulators ABBVIE INC. 2005-01-20 US claimed
US-7115767-B2 Tetraline derivatives as ghrelin receptor modulators ABBOTT LABORATORIES (US) 2006-10-03 US disclosed
US-20050014794-A1 Tetraline derivatives as ghrelin receptor modulators ABBVIE INC. 2005-01-20 US 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-20050014794-A1 Tetraline derivatives as ghrelin receptor modulators GPR119, GHSR, GIPR GHSR 2/4885NOX1 3818/4885CTSL 2224/4885

“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.