SCHEMBL31683295

SCHEMBL31683295

CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(C)C)C(C)C)C(C)C)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 7/20 0.58
▸ NPY4R P50391 7/20 0.58
▸ NPY5R Q15761 7/20 0.58
▸ NPY1R P25929 5/20 0.58
▸ TFPI P10646 4/20 0.56
▸ RAMP3 O60896 6/20 0.55
▸ CALCR P30988 6/20 0.55
▸ CXCR4 P61073 2/20 0.55

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
SCHEMBL31688335 0.93 NPY2R (0.52) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31683489 0.92 RAMP3 (0.56) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30526237 0.90 NPY2R (0.60) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30726606 0.90 RAMP3 (0.54) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL31222190 0.90 RAMP3 (0.55) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30906441 0.90 NPY2R (0.56) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29855903 0.89 NPY2R (0.53) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30906414 0.89 NPY2R (0.56) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30607285 0.89 CXCR4 (0.58) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30648444 0.88 NPY2R (0.51) NPY2RNPY4RNPY5RNPY1RTFPI

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-20250283037-A1 METHODS FOR STIMULATING AND TRANSDUCING T CELLS JUNO THERAPEUTICS GMBH (DE) 2025-09-11 — — US disclosed
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