SCHEMBL31520000

SCHEMBL31520000

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

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 7/20 0.60
▸ NPY4R P50391 7/20 0.60
▸ NPY5R Q15761 7/20 0.60
▸ NPY1R P25929 5/20 0.60
▸ IL23R Q5VWK5 1/20 0.59
▸ TFPI P10646 4/20 0.57
▸ C5AR1 P21730 1/20 0.56
▸ RAMP3 O60896 1/20 0.56
▸ CALCR P30988 1/20 0.56
▸ KDM1A O60341 2/20 0.55
▸ NMUR2 Q9GZQ4 2/20 0.55
▸ NMUR1 Q9HB89 2/20 0.55
▸ MAOB P27338 1/20 0.54
▸ KDM5A P29375 1/20 0.54
▸ KDM1B Q8NB78 1/20 0.54

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
SCHEMBL29847946 0.89 NMUR2 (0.58) NPY2RNPY4RNPY5RNPY1RC5AR1
SCHEMBL31174223 0.88 NPY2R (0.64) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30432597 0.86 NPY2R (0.67) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31519873 0.85 OPRD1 (0.62) NPY2RNPY4RNPY5RNPY1RIL23R
SCHEMBL30607473 0.85 NPY2R (0.63) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30331574 0.85 KDM1A (0.63) NPY2RNPY4RNPY5RNPY1RIL23R
SCHEMBL11150031 0.85 NPY2R (0.73) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29678305 0.84 IL23R (0.59) IL23RC5AR1RAMP3CALCRNMUR2
SCHEMBL30061928 0.84 IL23R (0.61) NPY2RNPY4RNPY5RNPY1RIL23R
SCHEMBL29972798 0.84 C5AR1 (0.56) IL23RC5AR1

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-119912534-A Amphiphilic cationic antibacterial polypeptide and application thereof 浙江长生鸟健康科技股份有限公司 2025-05-02 — — CN disclosed
Send feedback