SCHEMBL30492107

SCHEMBL30492107

N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCN)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PRKACB P22694 1/20 0.57
▸ NPBWR1 P48145 1/20 0.54
▸ BMP1 P13497 1/20 0.53
▸ PPARG P37231 1/20 0.51
▸ EPHX2 P34913 1/20 0.51
▸ GHSR Q92847 3/20 0.51
▸ NMBR P28336 1/20 0.51
▸ KISS1R Q969F8 1/20 0.51
▸ MC4R P32245 2/20 0.50

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
SCHEMBL29485117 0.97 PRKACB (0.55) PRKACBNPBWR1BMP1PPARGEPHX2
SCHEMBL30452484 0.92 NPBWR1 (0.57) PRKACBNPBWR1GHSR
SCHEMBL29485122 0.92 GHSR (0.54) PRKACBEPHX2GHSRKISS1RMC4R
SCHEMBL31593250 0.92 GHSR (0.58) PRKACBNPBWR1GHSRNMBRMC4R
SCHEMBL29511125 0.91 PRKACB (0.57) PRKACBNPBWR1BMP1GHSRNMBR
SCHEMBL30028027 0.90 GHSR (0.53) PRKACBGHSRNMBR
SCHEMBL30990571 0.89 GHSR (0.56) PRKACBGHSRNMBR
SCHEMBL29511112 0.89 GHSR (0.56) PRKACBGHSRNMBR
SCHEMBL29641046 0.89 GHSR (0.56) PRKACBGHSRNMBR
SCHEMBL31593359 0.88 GHSR (0.56) PRKACBNPBWR1GHSRNMBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230372525-A1 TRANSGLUTAMINASE CONJUGATION METHOD WITH AMINO ACID-BASED LINKERS ARARIS BIOTECH AG (CH) 2023-11-23 — — US disclosed
CN-116406302-A Method of transglutaminase conjugation with amino acid based linkers 阿拉里斯生物技术股份公司 2023-07-07 — — CN 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-20230372525-A1 TRANSGLUTAMINASE CONJUGATION METHOD WITH AMINO ACID-BASED LINKERS SP1, GLUL, TGM2 PRKACB 4811/4885NPBWR1 1580/4885BMP1 1948/4885

“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.

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