SCHEMBL15870228

SCHEMBL15870228

CNC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCOCCOCCOCCOCCNC(=O)CCN1C(=O)C=CC1=O)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 4/20 0.34
▸ GLP1R P43220 8/20 0.34
▸ OPRK1 P41145 2/20 0.33
▸ HRH1 P35367 2/20 0.33
▸ NPY1R P25929 1/20 0.33
▸ NPY4R P50391 1/20 0.33
▸ SIRT2 Q8IXJ6 1/20 0.32
▸ FURIN P09958 1/20 0.32

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
SCHEMBL13805702 0.94 FURIN (0.32) FAPGLP1ROPRK1NPY1RNPY4R
SCHEMBL21297142 0.93 FAP (0.35) FAPHRH1NPY1RNPY4RSIRT2
SCHEMBL25787322 0.93 FAP (0.35) FAPHRH1NPY1RNPY4RSIRT2
SCHEMBL21297140 0.93 FAP (0.35) FAPHRH1NPY1RNPY4RSIRT2
SCHEMBL21297079 0.93 FAP (0.35) FAPHRH1NPY1RNPY4RSIRT2
SCHEMBL19776684 0.93 GLP1R (0.40) FAPGLP1RNPY1RFURIN
SCHEMBL22841031 0.93 GLP1R (0.33) FAPGLP1RHRH1NPY1RNPY4R
SCHEMBL17841870 0.93 GLP1R (0.40) FAPGLP1RNPY1RFURIN
SCHEMBL22115954 0.93 GLP1R (0.40) FAPGLP1RNPY1RFURIN
SCHEMBL20263703 0.93 GLP1R (0.40) FAPGLP1RNPY1RFURIN

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-9089614-B2 Hydrophilic self-immolative linkers and conjugates thereof BIOALLIANCE C.V. (NL) 2015-07-28 — — US disclosed
US-20140193437-A1 HYDROPHILIC SELF-IMMOLATIVE LINKERS AND CONJUGATES THEREOF BIOALLIANCE C.V. (NL) 2014-07-10 — — 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-20140193437-A1 HYDROPHILIC SELF-IMMOLATIVE LINKERS AND CONJUGATES THEREOF CD44, ABCG2, MCL1 FAP 2301/4885GLP1R 583/4885OPRK1 4676/4885

“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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