SCHEMBL27434236

SCHEMBL27434236

CC(C)Cc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CCOCCOCCOCCOCCN2C(=O)C=CC2=O)C(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 5/20 0.41
▸ FURIN P09958 3/20 0.38
▸ SYK P43405 1/20 0.38
▸ NPY4R P50391 4/20 0.37
▸ NPY5R Q15761 4/20 0.37
▸ NPY1R P25929 3/20 0.37
▸ NPY2R P49146 1/20 0.37
▸ IL23R Q5VWK5 2/20 0.36
▸ ITGB1 P05556 1/20 0.35
▸ ITGA4 P13612 1/20 0.35
▸ MAP1LC3B Q9GZQ8 1/20 0.35
▸ GLP1R P43220 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
SCHEMBL27434235 1.00 FAP (0.41) FAPFURINSYKNPY4RNPY5R
SCHEMBL27434329 1.00 FAP (0.41) FAPFURINSYKNPY4RNPY5R
SCHEMBL23347019 0.92 FAP (0.42) FAPFURINIL23RMAP1LC3B
SCHEMBL23330065 0.92 FAP (0.42) FAPFURINIL23RMAP1LC3B
SCHEMBL23347020 0.92 FAP (0.42) FAPFURINIL23RMAP1LC3B
SCHEMBL25094984 0.91 FAP (0.42) FAPFURINMAP1LC3B
SCHEMBL23347018 0.91 FAP (0.42) FAPFURINIL23RMAP1LC3B
SCHEMBL24829369 0.91 FAP (0.42) FAPFURINMAP1LC3B
SCHEMBL25094954 0.90 FAP (0.41) FAPFURINMAP1LC3B
SCHEMBL24164693 0.90 FAP (0.41) FAPFURINSYKIL23RMAP1LC3B

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 1971/4885FURIN 4013/4885SYK 1222/4885

“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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