SCHEMBL16509011

SCHEMBL16509011

CC(C)C[C@H](NC(=O)[C@@H](C)CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(N)=O)[C@@H](C)O)[C@@H](C)O

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 9/20 0.48
▸ NPY4R P50391 9/20 0.48
▸ NPY1R P25929 8/20 0.48
▸ NPY2R P49146 6/20 0.46
▸ TFPI P10646 1/20 0.46
▸ OPRL1 P41146 3/20 0.43

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
SCHEMBL16508113 0.91 NPY4R (0.51) NPY5RNPY4RNPY1RNPY2R
SCHEMBL16508141 0.91 TFPI (0.49) NPY5RNPY4RNPY1RNPY2RTFPI
SCHEMBL10168621 0.89 NPY4R (0.54) NPY5RNPY4RNPY1RNPY2R
SCHEMBL16508109 0.89 TFPI (0.49) NPY5RNPY4RNPY1RNPY2RTFPI
SCHEMBL16507930 0.89 TFPI (0.48) NPY5RNPY4RNPY1RNPY2RTFPI
SCHEMBL30890374 0.87 NPY4R (0.49) NPY5RNPY4RNPY1RNPY2ROPRL1
SCHEMBL30890407 0.87 NPY4R (0.49) NPY5RNPY4RNPY1RNPY2ROPRL1
SCHEMBL16508060 0.87 NPY5R (0.49) NPY5RNPY4RNPY1RNPY2RTFPI
SCHEMBL16508153 0.87 TFPI (0.46) NPY5RNPY4RNPY1RNPY2RTFPI
SCHEMBL16507857 0.87 NMT2 (0.46) —

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110301087-A1 CRF1 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. 2011-12-08 — — 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-20110301087-A1 CRF1 RECEPTOR COMPOUNDS CRHR1, CRH, CRHR2 NPY5R 149/4885NPY4R 109/4885NPY1R 47/4885

“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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