SCHEMBL29362632

SCHEMBL29362632

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

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 4/20 0.61
▸ F2 P00734 4/20 0.60
▸ C5AR1 P21730 1/20 0.59
▸ MC4R P32245 1/20 0.59
▸ NMUR2 Q9GZQ4 4/20 0.58
▸ NMUR1 Q9HB89 4/20 0.58
▸ CALCR P30988 2/20 0.58
▸ RAMP3 O60896 1/20 0.58

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
SCHEMBL30262245 0.91 MC4R (0.62) APLNRF2C5AR1MC4RNMUR2
SCHEMBL30576961 0.89 RAMP3 (0.59) APLNRC5AR1CALCRRAMP3
SCHEMBL31182616 0.88 RAMP3 (0.63) F2CALCRRAMP3
SCHEMBL30058340 0.88 F2 (0.63) APLNRF2C5AR1CALCRRAMP3
SCHEMBL29521314 0.88 APLNR (0.61) APLNRF2C5AR1NMUR2NMUR1
SCHEMBL30423484 0.88 GLP1R (0.60) CALCRRAMP3
SCHEMBL30262247 0.88 C5AR1 (0.62) APLNRF2C5AR1MC4RNMUR2
SCHEMBL30512520 0.87 F2 (0.61) APLNRF2C5AR1MC4RNMUR2
SCHEMBL31182896 0.87 CALCR (0.66) CALCR
SCHEMBL31182654 0.87 NPY2R (0.66) C5AR1CALCRRAMP3

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
US-20220089719-A1 CONSTRUCTS TARGETING LABYRINTHIN OR A PORTION THEREOF AND USES THEREOF LABYRX IMMUNOLOGIC THERAPEUTICS (USA) LIMITED (US) 2022-03-24 — — US disclosed
CN-113993892-A Constructs targeting labyrinth proteins or parts thereof and uses of said constructs 莱比锡免疫治疗(美国)有限公司 2022-01-28 — — CN disclosed
Send feedback