SCHEMBL30919262

SCHEMBL30919262

CC(=O)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](N)C(C)C)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 5/20 0.51
SIRT5 Q9NXA8 2/20 0.45
ALDH1A1 P00352 1/20 0.43
CAPN1 P07384 1/20 0.43
GNPAT O15228 1/20 0.41
NPY4R P50391 4/20 0.39
NPY1R P25929 3/20 0.39
NPY2R P49146 3/20 0.39
NPY5R Q15761 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KISS1R Q969F8 1/20 0.38
NOD1 Q9Y239 1/20 0.38
SIRT6 Q8N6T7 1/20 0.38
SIRT1 Q96EB6 1/20 0.38

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
SCHEMBL14075788 0.92 FOLH1 (0.58) FOLH1SIRT5GNPATSMN1; SMN2NOD1
SCHEMBL29394341 0.92 FOLH1 (0.58) FOLH1SIRT5GNPATSMN1; SMN2NOD1
SCHEMBL2107432 0.86 FOLH1 (0.46) FOLH1NPY4RNPY1RNPY2RNPY5R
SCHEMBL1711082 0.86 FOLH1 (0.46) FOLH1NPY4RNPY1RNPY2RNPY5R
SCHEMBL27736911 0.86 FOLH1 (0.46) FOLH1NPY4RNPY1RNPY2RNPY5R
SCHEMBL1711325 0.85 CPB2 (0.47) FOLH1NPY4RNPY1RNPY2R
SCHEMBL1711321 0.85 CPB2 (0.47) FOLH1NPY4RNPY1RNPY2R
SCHEMBL1711732 0.85 CPB2 (0.47) FOLH1NPY4RNPY1RNPY2R
SCHEMBL1711738 0.85 CPB2 (0.47) FOLH1NPY4RNPY1RNPY2R
SCHEMBL31099441 0.85 FOLH1 (0.56) FOLH1SIRT5ALDH1A1CAPN1GNPAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4612124-A1 AZOTOMYCIN PRODRUGS WITH PREFERENTIAL TUMOR DELIVERY The Johns Hopkins University (US) 2025-09-10 EP claimed
WO-2024097320-A1 AZOTOMYCIN PRODRUGS WITH PREFERENTIAL TUMOR DELIVERY THE JOHNS HOPKINS UNIVERSITY (US) 2024-05-10 WO claimed
EP-4612124-A1 AZOTOMYCIN PRODRUGS WITH PREFERENTIAL TUMOR DELIVERY The Johns Hopkins University (US) 2025-09-10 EP disclosed
WO-2024097320-A1 AZOTOMYCIN PRODRUGS WITH PREFERENTIAL TUMOR DELIVERY THE JOHNS HOPKINS UNIVERSITY (US) 2024-05-10 WO disclosed