SCHEMBL7195144

SCHEMBL7195144

N=C(N)NCCCC(N)C(=O)NC(Cc1c[nH]cn1)C(=O)N1CCCC1C(=O)NC(CS)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 3/20 0.50
▸ C5AR1 P21730 2/20 0.47
▸ CTSL P07711 3/20 0.46
▸ CTSS P25774 3/20 0.46
▸ CTSK P43235 3/20 0.46
▸ CTSH P09668 1/20 0.46
▸ PLK1 P53350 1/20 0.41
▸ NTSR2 O95665 1/20 0.40
▸ NTSR1 P30989 1/20 0.40
▸ SORT1 Q99523 1/20 0.40
▸ MC4R P32245 1/20 0.40
▸ OPRM1 P35372 3/20 0.39
▸ OPRD1 P41143 1/20 0.39
▸ OPRK1 P41145 2/20 0.39
▸ EPHA2 P29317 1/20 0.39

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
SCHEMBL7195147 1.00 APLNR (0.50) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL30364356 0.94 APLNR (0.48) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL31683847 0.90 C5AR1 (0.44) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL29607931 0.89 C5AR1 (0.55) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL31683844 0.87 APLNR (0.46) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL29630628 0.87 APLNR (0.49) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL29608840 0.87 C5AR1 (0.58) APLNRC5AR1MC4ROPRM1OPRK1
SCHEMBL29608843 0.87 C5AR1 (0.58) APLNRC5AR1MC4ROPRM1OPRK1
SCHEMBL29607221 0.86 C5AR1 (0.53) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL29591975 0.86 APLNR (0.51) APLNRC5AR1CTSLCTSSCTSK

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6589937-B1 Anti-dementia drug which contains one or more of these new peptides and has a high blood brain barrier (BBB) permeability and furthermore is low in a side effect. KABUSHIKI KAISHA YAKULT HONSHA (JP) 2003-07-08 — — US disclosed
EP-0919567-B1 NOVEL PEPTIDES AND NOOTROPIC AGENT YAKULT HONSHA KK (JP) 2001-10-24 — — EP disclosed
EP-0919567-A1 NOVEL PEPTIDES AND NOOTROPIC AGENT KABUSHIKI KAISHA YAKULT HONSHA (JP) 1999-06-02 — — EP disclosed
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