SCHEMBL13805702

SCHEMBL13805702

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

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 4/20 0.32
▸ FAP Q12884 3/20 0.32
▸ NPY1R P25929 2/20 0.32
▸ NPY4R P50391 2/20 0.32
▸ C3AR1 Q16581 1/20 0.32
▸ GLP1R P43220 5/20 0.31
▸ OPRK1 P41145 2/20 0.31
▸ POLB P06746 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31

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
SCHEMBL15870228 0.94 FAP (0.34) FURINFAPNPY1RNPY4RGLP1R
SCHEMBL13805694 0.93 C3AR1 (0.32) FURINFAPNPY1RNPY4RC3AR1
SCHEMBL13310984 0.90 FAP (0.36) FURINFAPNPY1RNPY4ROPRK1
SCHEMBL13311280 0.90 POLB (0.33) POLBHSD17B10
SCHEMBL14012282 0.89 FURIN (0.41) FURINFAPNPY1RNPY4ROPRK1
SCHEMBL13311080 0.89 FURIN (0.36) FURINFAPNPY1RNPY4RC3AR1
SCHEMBL13311151 0.88 FURIN (0.36) FURINFAPNPY1RNPY4ROPRK1
SCHEMBL21297142 0.87 FAP (0.35) FURINFAPNPY1RNPY4RC3AR1
SCHEMBL21297079 0.87 FAP (0.35) FURINFAPNPY1RNPY4RC3AR1
SCHEMBL21297140 0.87 FAP (0.35) FURINFAPNPY1RNPY4RC3AR1

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-20090162372-A1 FIBRONECTIN ED-B ANTIBODIES, CONJUGATES THEREOF, AND METHODS OF USE MEDAREX, INC. (US) 2009-06-25 — — US disclosed
US-20090162372-A1 FIBRONECTIN ED-B ANTIBODIES, CONJUGATES THEREOF, AND METHODS OF USE MEDAREX, INC. (US) 2009-06-25 — — 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-20090162372-A1 FIBRONECTIN ED-B ANTIBODIES, CONJUGATES THEREOF, AND METHODS OF USE FN1, EDNRB, EDF1 FURIN 477/4885FAP 741/4885NPY1R 2832/4885

“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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