SCHEMBL30038873

SCHEMBL30038873

CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 4/20 0.57
▸ NPY1R P25929 3/20 0.57
▸ NPY2R P49146 3/20 0.57
▸ KISS1R Q969F8 16/20 0.55
▸ OPRD1 P41143 1/20 0.52
▸ NPY5R Q15761 2/20 0.51

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
SCHEMBL30037959 0.95 NPY4R (0.61) NPY4RNPY1RNPY2RKISS1RNPY5R
SCHEMBL29939673 0.92 KISS1R (0.57) KISS1ROPRD1
SCHEMBL30973981 0.89 NPY4R (0.56) NPY4RNPY1RNPY2RNPY5R
SCHEMBL30471367 0.89 NPY4R (0.54) NPY4RNPY1RNPY2ROPRD1NPY5R
SCHEMBL30974256 0.87 NPY4R (0.51) NPY4RNPY1RNPY2R
SCHEMBL30350938 0.87 KISS1R (0.57) NPY4RNPY1RNPY2RKISS1ROPRD1
SCHEMBL30038033 0.87 KISS1R (0.61) NPY4RNPY1RNPY2RKISS1RNPY5R
SCHEMBL32665677 0.85 TFPI (0.53) NPY4RNPY1RNPY2RKISS1R
SCHEMBL30799753 0.85 NPY4R (0.66) NPY4RNPY1RNPY2RKISS1RNPY5R
SCHEMBL30271263 0.85 NPY4R (0.61) NPY4RNPY1RNPY2RKISS1ROPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4329827-A1 TARGETING SYSTEM FOR CANCER COMPRISING A RADIOISOTOPE Alphathera AG (CH) 2024-03-06 — — EP claimed
WO-2022231424-A1 TARGETING SYSTEM FOR CANCER COMPRISING A RADIOISOTOPE ALPHATHERA AG (CH) 2022-11-03 — — WO claimed
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