SCHEMBL27433508

SCHEMBL27433508

CC(C)Cc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)C(NC(=O)[C@H](CS(=O)(=O)O)NC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 5/20 0.43
▸ NPY4R P50391 9/20 0.41
▸ NPY5R Q15761 6/20 0.41
▸ NPY1R P25929 5/20 0.41
▸ NPY2R P49146 3/20 0.41
▸ ITGB1 P05556 1/20 0.37
▸ ITGA5 P08648 1/20 0.37
▸ KISS1R Q969F8 1/20 0.36
▸ FURIN P09958 2/20 0.35
▸ TRPV1 Q8NER1 1/20 0.35

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
SCHEMBL27433843 0.92 FAP (0.45) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL27433756 0.92 FAP (0.46) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL27421384 0.92 FAP (0.46) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL27433100 0.92 FAP (0.46) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL21861811 0.91 FAP (0.45) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL21912925 0.91 FAP (0.45) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL17722946 0.91 FAP (0.45) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL22314405 0.91 FAP (0.45) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL20935053 0.91 FAP (0.45) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL17815311 0.91 FAP (0.45) FAPNPY4RNPY5RNPY1RNPY2R

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-20240218011-A1 GLUCOCORTICOID RECEPTOR AGONISTS AND CONJUGATES THEREOF FIREFLY BIO, INC. 2024-07-04 — — 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-20240218011-A1 GLUCOCORTICOID RECEPTOR AGONISTS AND CONJUGATES THEREOF NR3C1, NR3C2, MC2R FAP 1971/4885NPY4R 460/4885NPY5R 546/4885

“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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