SCHEMBL14288709

SCHEMBL14288709

CC(C)(N)CC(=O)NC1CSc2ccccc2N(Cc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)C1=O

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.58
AGTR1 P30556 1/20 0.58
XIAP P98170 1/20 0.43
F7 P08709 5/20 0.39
F3 P13726 5/20 0.39
F2 P00734 2/20 0.39
ACE P12821 4/20 0.38
MME P08473 3/20 0.38
RIPK1 Q13546 1/20 0.34

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
SCHEMBL9025758 1.00 GHSR (0.58) GHSRAGTR1XIAPF7F3
Trifluoroacetic Acid SCHEMBL9104507 0.96 GHSR (0.54) GHSRAGTR1XIAPF7F3
SCHEMBL9024591 0.89 GHSR (0.46) GHSRAGTR1XIAPF7F3
SCHEMBL9025080 0.89 GHSR (0.46) GHSRAGTR1XIAPF7F3
SCHEMBL9024321 0.88 GHSR (0.59) GHSRAGTR1XIAP
SCHEMBL9024343 0.88 GHSR (0.65) GHSRAGTR1XIAP
SCHEMBL9107917 0.87 GHSR (0.45) GHSRAGTR1XIAPF7F3
SCHEMBL9024772 0.87 GHSR (0.52) GHSRAGTR1
SCHEMBL9087316 0.87 GHSR (0.58) GHSRAGTR1XIAPF7F3
SCHEMBL9088512 0.87 GHSR (0.54) GHSRAGTR1XIAPF7F3

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-20080027038-A1 N-Acylated lipophilic amino acid derivatives KAKEN PHARMACEUTICAL CO., LTD. (JP) 2008-01-31 US disclosed
US-20080027038-A1 N-Acylated lipophilic amino acid derivatives KAKEN PHARMACEUTICAL CO., LTD. (JP) 2008-01-31 US disclosed
US-7279573-B2 Amide derivatives KAKEN PHARMACEUTICAL CO., LTD. (JP) 2007-10-09 US disclosed
US-7279573-B2 Amide derivatives KAKEN PHARMACEUTICAL CO., LTD. (JP) 2007-10-09 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-20080027038-A1 N-Acylated lipophilic amino acid derivatives GHRHR, NPPA, SSTR5 GHSR 7/4885AGTR1 297/4885XIAP 4180/4885

“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.