SCHEMBL22010347

SCHEMBL22010347

CC(C)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)Nc1ccc(COC=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SSTR3 P32745 1/20 0.51
▸ CALCRL Q16602 1/20 0.47
▸ LTA4H P09960 1/20 0.46
▸ MMP3 P08254 2/20 0.44
▸ ECE1 P42892 1/20 0.43
▸ SIRT2 Q8IXJ6 1/20 0.42
▸ SIRT1 Q96EB6 1/20 0.42
▸ CPB1 P15086 1/20 0.41
▸ CPB2 Q96IY4 1/20 0.41
▸ PLG P00747 1/20 0.41
▸ KDM1A O60341 3/20 0.41
▸ MAOA P21397 2/20 0.41
▸ KDM1B Q8NB78 1/20 0.41
▸ RCOR1 Q9UKL0 1/20 0.41
▸ GHSR Q92847 1/20 0.41

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
SCHEMBL19340304 0.92 SSTR3 (0.51) SSTR3CALCRLLTA4HMMP3ECE1
SCHEMBL12245289 0.91 SSTR3 (0.53) SSTR3CALCRLLTA4HMMP3ECE1
SCHEMBL26439273 0.89 SSTR3 (0.53) SSTR3CALCRLLTA4HMMP3ECE1
SCHEMBL19403504 0.88 SSTR3 (0.54) SSTR3CALCRLLTA4HMMP3ECE1
SCHEMBL19231508 0.88 SSTR3 (0.54) SSTR3CALCRLLTA4HMMP3ECE1
SCHEMBL25475432 0.88 SSTR3 (0.54) SSTR3CALCRLLTA4HMMP3ECE1
SCHEMBL21474554 0.87 SSTR3 (0.55) SSTR3CALCRLLTA4HMMP3ECE1
SCHEMBL20133503 0.84 MMP3 (0.47) SSTR3CALCRLLTA4HMMP3SIRT2
SCHEMBL25475433 0.82 SSTR3 (0.48) SSTR3CALCRLLTA4HMMP3ECE1
SCHEMBL25475918 0.81 SSTR3 (0.48) SSTR3CALCRLLTA4HMMP3ECE1

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-11692043-B2 Peptidomimetic compounds and antibody-drug conjugates thereof MEDIMMUNE LIMITED (GB) 2023-07-04 — — US disclosed
US-20200157240-A1 PEPTIDOMIMETIC COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF MEDIMMUNE LIMITED (GB) 2020-05-21 — — 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-20200157240-A1 PEPTIDOMIMETIC COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF DNPEP, LNPEP, VIP SSTR3 228/4885CALCRL 1443/4885LTA4H 3290/4885
US-11692043-B2 Peptidomimetic compounds and antibody-drug conjugates thereof DNPEP, LNPEP, VIP SSTR3 228/4885CALCRL 1443/4885LTA4H 3290/4885

“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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