SCHEMBL24517136

SCHEMBL24517136

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CCCCCC(NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)C(=O)N1CCCCC1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 5/20 0.49
▸ NTSR2 O95665 3/20 0.49
▸ F2 P00734 2/20 0.48
▸ OPRD1 P41143 5/20 0.48
▸ SORT1 Q99523 1/20 0.45
▸ OPRK1 P41145 1/20 0.45
▸ NPBWR1 P48145 1/20 0.45

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
SCHEMBL24504160 0.93 NTSR1 (0.48) NTSR1NTSR2F2OPRD1SORT1
SCHEMBL24504159 0.88 F2 (0.49) NTSR1NTSR2F2OPRD1SORT1
SCHEMBL24517139 0.84 OPRD1 (0.54) NTSR1NTSR2F2OPRD1OPRK1
SCHEMBL24516989 0.82 F2 (0.56) NTSR1NTSR2F2OPRD1
SCHEMBL24504179 0.82 F2 (0.54) NTSR1NTSR2F2OPRD1OPRK1
SCHEMBL26189977 0.81 CPB2 (0.41) OPRD1OPRK1
SCHEMBL9058846 0.79 OPRD1 (0.56) NTSR1NTSR2F2OPRD1SORT1
SCHEMBL24473374 0.78 F2 (0.51) NTSR1NTSR2F2SORT1
SCHEMBL31253371 0.76 OPRD1 (0.52) NTSR1NTSR2F2OPRD1OPRK1
SCHEMBL16847816 0.76 F2 (0.52) NTSR1NTSR2F2OPRD1OPRK1

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-11692007-B2 Amino deprotection using 3-(diethylamino)propylamine Alma Mater Studiorum—Università di Bologna (IT) 2023-07-04 — — US disclosed
US-20220185842-A1 AMINO DEPROTECTION USING 3-(DIETHYLAMINO)PROPYLAMINE Alma Mater Studiorum - Università di Bologna (IT) 2022-06-16 — — 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 (2 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-20220185842-A1 AMINO DEPROTECTION USING 3-(DIETHYLAMINO)PROPYLAMINE PEPD, ANPEP, DNPEP NTSR1 168/4885NTSR2 180/4885F2 1522/4885
US-11692007-B2 Amino deprotection using 3-(diethylamino)propylamine PEPD, ANPEP, DNPEP NTSR1 168/4885NTSR2 180/4885F2 1522/4885

“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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