SCHEMBL31664368

SCHEMBL31664368

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 6/20 0.68
▸ GLP1R P43220 11/20 0.66
▸ ECE1 P42892 1/20 0.66
▸ MUS81 Q96NY9 1/20 0.66
▸ PTH1R Q03431 3/20 0.64
▸ CCKBR P32239 1/20 0.63

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
SCHEMBL31664370 0.97 RXFP1 (0.68) RXFP1GLP1RECE1MUS81PTH1R
SCHEMBL31664384 0.94 RXFP1 (0.66) RXFP1GLP1RECE1MUS81PTH1R
SCHEMBL31683265 0.93 GLP1R (0.67) RXFP1GLP1RECE1MUS81PTH1R
SCHEMBL30658325 0.92 RXFP1 (0.69) RXFP1GLP1RECE1MUS81PTH1R
SCHEMBL31683247 0.92 GLP1R (0.65) RXFP1GLP1RECE1MUS81CCKBR
SCHEMBL30433053 0.91 GLP1R (0.67) RXFP1GLP1RECE1MUS81PTH1R
SCHEMBL29880080 0.91 PTH1R (0.64) GLP1RECE1MUS81PTH1RCCKBR
SCHEMBL29527049 0.91 PTH1R (0.72) RXFP1GLP1RECE1MUS81PTH1R
SCHEMBL30906515 0.90 GLP1R (0.64) RXFP1GLP1RECE1MUS81PTH1R
SCHEMBL30118955 0.90 GLP1R (0.71) GLP1RECE1MUS81

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-20250237628-A1 CELL SELECTION AND/OR STIMULATION DEVICES AND METHODS OF USE JUNO THERAPEUTICS GMBH (DE) 2025-07-24 — — US disclosed
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