SCHEMBL29346067

SCHEMBL29346067

CC(C)[C@H](NC(=O)[C@H](CCCCNC(=O)OCCOCCOCCOCCOCCOCCN(C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)NC(=O)CCCCCN1C(=O)C=CC1=O)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 5/20 0.42
▸ NPY5R Q15761 4/20 0.32
▸ NPY1R P25929 3/20 0.32
▸ NPY4R P50391 3/20 0.32
▸ MAP1LC3B Q9GZQ8 2/20 0.32
▸ NPY2R P49146 1/20 0.32
▸ GLP1R P43220 7/20 0.31
▸ SCTR P47872 1/20 0.31
▸ FURIN P09958 2/20 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
SCHEMBL24864405 0.95 FAP (0.40) FAPNPY5RNPY1RNPY4RNPY2R
SCHEMBL29340481 0.94 FAP (0.40) FAPNPY5RNPY1RNPY4RNPY2R
SCHEMBL24864498 0.94 FAP (0.40) FAPGLP1R
SCHEMBL24864507 0.93 FAP (0.40) FAPNPY5RNPY1RNPY4RNPY2R
SCHEMBL24864408 0.92 FAP (0.40) FAPGLP1RSCTRFURIN
SCHEMBL24864380 0.92 FAP (0.40) FAPGLP1RFURIN
SCHEMBL29346082 0.92 FAP (0.40) FAPGLP1RFURIN
SCHEMBL24864625 0.91 FAP (0.38) FAPGLP1RSCTR
SCHEMBL24864509 0.90 NPY4R (0.37) FAPNPY5RNPY1RNPY4RNPY2R
SCHEMBL29346068 0.89 FAP (0.41) FAPNPY5RNPY1RNPY4RMAP1LC3B

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
WO-2024151890-A1 LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME PROFOUNDBIO US CO. (US) 2024-07-18 — — WO disclosed
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