SCHEMBL30607166

SCHEMBL30607166

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 20/20 0.62
▸ NTSR2 O95665 18/20 0.62
▸ SORT1 Q99523 16/20 0.62

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
SCHEMBL30864885 0.88 NTSR1 (0.78) NTSR1NTSR2SORT1
SCHEMBL29769336 0.88 NTSR1 (0.59) NTSR1NTSR2SORT1
SCHEMBL30037824 0.88 NTSR2 (0.73) NTSR1NTSR2SORT1
SCHEMBL30034783 0.88 NTSR2 (0.73) NTSR1NTSR2SORT1
SCHEMBL29786697 0.88 MAPK8 (0.58) NTSR1NTSR2SORT1
SCHEMBL30360392 0.87 NTSR2 (0.73) NTSR1NTSR2SORT1
SCHEMBL31694383 0.87 NTSR1 (0.68) NTSR1NTSR2SORT1
SCHEMBL29770298 0.87 NPY4R (0.57) NTSR1NTSR2SORT1
SCHEMBL29464015 0.87 MAPK8 (0.59) NTSR1NTSR2SORT1
SCHEMBL31324070 0.87 NTSR1 (0.65) NTSR1NTSR2SORT1

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
CN-114478797-B Hydrolysis targeting chimeric body targeting DDX24 protein and application thereof 中山大学附属第五医院 2023-10-27 — — CN claimed
Send feedback