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Sugi Predict / Compounds / SCHEMBL31688333

SCHEMBL31688333

SCHEMBL31688333

CC(C)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(C)C)C(C)C

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 2/20 0.65
▸ C5AR1 P21730 1/20 0.63
▸ F2 P00734 4/20 0.60
▸ MC4R P32245 1/20 0.57
▸ TFPI P10646 1/20 0.56
▸ RAMP3 O60896 3/20 0.56
▸ CALCR P30988 3/20 0.56
▸ GLP1R P43220 4/20 0.55
▸ GCGR P47871 3/20 0.55
▸ SCTR P47872 1/20 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
SCHEMBL31182616 0.90 RAMP3 (0.63) F2RAMP3CALCRGLP1RGCGR
SCHEMBL29801157 0.89 APLNR (0.60) APLNRC5AR1F2RAMP3CALCR
SCHEMBL30524357 0.89 APLNR (0.67) APLNRC5AR1CALCRGLP1RGCGR
SCHEMBL30437391 0.89 APLNR (0.67) APLNRC5AR1MC4RTFPICALCR
SCHEMBL30930534 0.89 F2 (0.60) APLNRC5AR1F2CALCRGLP1R
SCHEMBL31688331 0.89 APLNR (0.58) APLNRC5AR1F2MC4R
SCHEMBL30495678 0.89 C5AR1 (0.66) APLNRC5AR1MC4RTFPI
SCHEMBL29798261 0.88 C5AR1 (0.60) APLNRC5AR1MC4RTFPICALCR
SCHEMBL30262218 0.88 C5AR1 (0.59) C5AR1RAMP3CALCRGLP1RGCGR
SCHEMBL31182477 0.88 APLNR (0.64) APLNRC5AR1F2TFPI

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-20250297282-A1 VIRAL-BINDING PROTEIN AND RELATED REAGENTS, ARTICLES, AND METHODS OF USE JUNO THERAPEUTICS GMBH (DE) 2025-09-25 — — US disclosed
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