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Sugi Predict / Compounds / SCHEMBL5499557

SCHEMBL5499557

SCHEMBL5499557

N=C(N)NCCC[C@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)CCc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 3/20 0.61
▸ NPBWR1 P48145 1/20 0.60
▸ IL23R Q5VWK5 15/20 0.59

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
SCHEMBL5498747 0.96 KISS1R (0.62) KISS1RNPBWR1IL23R
SCHEMBL5498316 0.93 KISS1R (0.55) KISS1RNPBWR1IL23R
SCHEMBL5990130 0.93 KISS1R (0.59) KISS1RNPBWR1IL23R
SCHEMBL5501891 0.90 KISS1R (0.55) KISS1RNPBWR1IL23R
SCHEMBL5989629 0.89 KISS1R (0.56) KISS1RNPBWR1IL23R
SCHEMBL29929571 0.87 KISS1R (0.66) KISS1R
SCHEMBL5998042 0.87 KISS1R (0.66) KISS1R
SCHEMBL14220306 0.86 IL23R (0.57) KISS1RNPBWR1IL23R
SCHEMBL31206256 0.84 KISS1R (0.55) KISS1RIL23R
SCHEMBL30264785 0.84 GHSR (0.55) KISS1RIL23R

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-7307063-B2 Melanocortin metallopeptides for treatment of sexual dysfunction PALATIN TECHNOLOGIES, INC. (US) 2007-12-11 — — US disclosed
WO-2002064091-A2 MELANOCORTIN METALLOPEPTIDES FOR TREATMENT OF SEXUAL DYSFUNCTION PALATIN TECHNOLOGIES, INC. (US) 2002-08-22 — — WO disclosed
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