SCHEMBL18089372

SCHEMBL18089372

C#CCCC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H]1CSSCC(C(=O)N[C@H](CO)[C@@H](C)O)NC(=O)C([C@@H](C)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC1=O

nearest known ligand 0.81

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SSTR4 P31391 10/20 0.81
▸ SSTR2 P30874 16/20 0.80
▸ SSTR5 P35346 11/20 0.80
▸ SSTR3 P32745 4/20 0.78

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
SCHEMBL23901126 0.91 SSTR2 (0.88) SSTR4SSTR2SSTR5SSTR3
SCHEMBL23482744 0.91 SSTR2 (0.88) SSTR4SSTR2SSTR5SSTR3
SCHEMBL24685237 0.91 SSTR4 (0.80) SSTR4SSTR2SSTR5SSTR3
SCHEMBL22388803 0.91 SSTR2 (0.87) SSTR4SSTR2SSTR5SSTR3
SCHEMBL22389054 0.91 SSTR2 (0.87) SSTR4SSTR2SSTR5SSTR3
SCHEMBL25504914 0.91 SSTR2 (0.87) SSTR4SSTR2SSTR5SSTR3
SCHEMBL10044662 0.91 SSTR4 (0.81) SSTR4SSTR2SSTR5SSTR3
SCHEMBL30338443 0.91 SSTR2 (0.86) SSTR4SSTR2SSTR5SSTR3
SCHEMBL21312714 0.90 SSTR4 (0.78) SSTR4SSTR2SSTR5SSTR3
SCHEMBL180440 0.90 SSTR4 (0.83) SSTR4SSTR2SSTR5SSTR3

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-20180078656-A1 CRYPTOPHYCIN-BASED ANTIBODY-DRUG CONJUGATES WITH NOVEL SELF-IMMOLATIVE LINKERS EXIRIS S.R.L. (IT) 2018-03-22 — — US disclosed
WO-2016146638-A1 CRYPTOPHYCIN-BASED ANTIBODY-DRUG CONJUGATES WITH NOVEL SELF-IMMOLATIVE LINKERS EXIRIS S.R.L. (IT) 2016-09-22 — — WO 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-20180078656-A1 CRYPTOPHYCIN-BASED ANTIBODY-DRUG CONJUGATES WITH NOVEL SELF-IMMOLATIVE LINKERS DNPEP, CDC16, PREP SSTR4 634/4885SSTR2 1096/4885SSTR5 731/4885

“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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