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SCHEMBL24864664

SCHEMBL24864664

CC(C)C[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 14/20 0.54
▸ NPY1R P25929 9/20 0.54
▸ NPY2R P49146 7/20 0.54
▸ NPY5R Q15761 6/20 0.54
▸ MMP3 P08254 2/20 0.42
▸ KISS1R Q969F8 1/20 0.41
▸ OPRK1 P41145 1/20 0.41
▸ NTSR2 O95665 1/20 0.40
▸ NTSR1 P30989 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL24864486 0.92 NPY4R (0.45) NPY4RNPY1RNPY2RNPY5RMMP3
SCHEMBL24864665 0.90 NPY4R (0.44) NPY4RNPY1RNPY2RNPY5R
SCHEMBL24864480 0.89 NPY4R (0.42) NPY4RNPY1RNPY2RNPY5R
SCHEMBL19553951 0.89 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RMMP3
SCHEMBL19553949 0.89 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RMMP3
SCHEMBL19553922 0.87 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RMMP3
SCHEMBL19553923 0.87 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RMMP3
SCHEMBL25167053 0.84 SPHK1 (0.47) NPY4RNPY1RNPY2RNPY5R
SCHEMBL12634420 0.83 TAAR1 (0.41) NPY4RNPY1RNPY2RNPY5R
SCHEMBL20435138 0.82 FURIN (0.45) —

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-2023280227-A2 LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME PROFOUNDBIO US CO. (US) 2023-01-12 — — WO disclosed