SCHEMBL29989836

SCHEMBL29989836

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

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPBWR1 P48145 7/20 0.55
▸ RXFP1 Q9HBX9 1/20 0.52
▸ IL23R Q5VWK5 2/20 0.51
▸ KISS1R Q969F8 1/20 0.49
▸ ECE1 P42892 1/20 0.49
▸ GLP1R P43220 1/20 0.49
▸ MUS81 Q96NY9 1/20 0.49
▸ GHSR Q92847 1/20 0.49
▸ PRMT1 Q99873 1/20 0.48

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
SCHEMBL30092983 0.97 NPBWR1 (0.58) NPBWR1RXFP1KISS1RECE1GLP1R
SCHEMBL30130552 0.96 RXFP1 (0.54) NPBWR1RXFP1IL23RKISS1RECE1
SCHEMBL30093099 0.96 NPBWR1 (0.59) NPBWR1RXFP1KISS1RECE1GLP1R
SCHEMBL30092970 0.96 NPBWR1 (0.59) NPBWR1RXFP1KISS1RECE1GLP1R
SCHEMBL30571042 0.96 NPBWR1 (0.59) NPBWR1RXFP1KISS1RECE1GLP1R
SCHEMBL30093124 0.95 RXFP1 (0.53) NPBWR1RXFP1IL23RKISS1RECE1
SCHEMBL30092924 0.93 RXFP1 (0.57) NPBWR1RXFP1IL23RKISS1RECE1
SCHEMBL30093061 0.93 RXFP1 (0.57) NPBWR1RXFP1IL23RKISS1RECE1
SCHEMBL30092976 0.93 RXFP1 (0.57) NPBWR1RXFP1IL23RKISS1RECE1
SCHEMBL30093112 0.93 RXFP1 (0.57) NPBWR1RXFP1IL23RKISS1RECE1

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-20220354957-A1 PEPTIDES TARGETING MACROPHAGES, AND CONJUGATES, COMPOSITIONS, AND USES THEREOF TWINPIG BIOLAB, INC. (KR) 2022-11-10 — — US disclosed
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