SCHEMBL28176391

SCHEMBL28176391

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

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 15/20 0.51
▸ MC4R P32245 2/20 0.48
▸ GHSR Q92847 2/20 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
SCHEMBL1693501 0.98 KISS1R (0.51) KISS1RMC4RGHSR
SCHEMBL2192156 0.93 CTSC (0.51) KISS1RMC4R
SCHEMBL30805681 0.90 KISS1R (0.55) KISS1RMC4RGHSR
SCHEMBL27745741 0.90 GHSR (0.49) GHSR
SCHEMBL2192640 0.89 MC4R (0.49) KISS1RMC4RGHSR
SCHEMBL28175417 0.89 CTSC (0.52) —
SCHEMBL30919241 0.89 KISS1R (0.55) KISS1RMC4RGHSR
SCHEMBL30919236 0.89 KISS1R (0.55) KISS1RMC4RGHSR
SCHEMBL31206184 0.88 KISS1R (0.55) KISS1RMC4RGHSR
SCHEMBL31541506 0.88 MC4R (0.59) KISS1RMC4RGHSR

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-107233564-A The treatment of biomembrane 莱特克斯生物制药股份有限公司 2017-10-10 — — CN disclosed
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