SCHEMBL7130547

SCHEMBL7130547

NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)C1CSCC(=O)N1

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TRHR P34981 6/20 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
SCHEMBL11759236 1.00 TRHR (0.59) TRHR
Water SCHEMBL11759957 0.99 TRHR (0.58) TRHR
Azetirelin SCHEMBL10703548 0.89 TRHR (0.62) TRHR
Azetirelin SCHEMBL250397 0.89 TRHR (0.62) TRHR
Azetirelin SCHEMBL27999417 0.89 TRHR (0.62) TRHR
Azetirelin SCHEMBL4958204 0.89 TRHR (0.62) TRHR
Azetirelin SCHEMBL7265691 0.89 TRHR (0.62) TRHR
SCHEMBL7773056 0.88 TRHR (0.56) TRHR
Protirelin SCHEMBL20659679 0.88 TRHR (0.71) TRHR
Protirelin SCHEMBL11798811 0.88 TRHR (0.71) TRHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0862429-A4 METHOD OF ADJUSTING THE CIRCADIAN RHYTHM OF A MAMMAL GRUENENTHAL GMBH (DE) 2003-05-28 — — EP claimed
EP-0862429-A1 METHOD OF ADJUSTING THE CIRCADIAN RHYTHM OF A MAMMAL Grünenthal GmbH (DE) 1998-09-09 — — EP claimed
WO-1997015301-A1 METHOD OF ADJUSTING THE CIRCADIAN RHYTHM OF A MAMMAL GRUENENTHAL GMBH (DE) 1997-05-01 — — WO claimed
US-4045556-A ANTIDEPRESSANTS, PYSCHOSTIMULANTS; SILYLATION SCHWERTNER EBERHARD 1977-08-30 — — US claimed
US-4906614-A Method of treating posttraumatic nervous injuries with dipeptide derivatives GRUENENTHAL GMBH (DE) 1990-03-06 — — US disclosed
EP-0331505-A1 A method for purification of liposome composition Takeda Chemical Industries, Ltd. (JP) 1989-09-06 — — EP disclosed
US-4442090-A ACYLATED AMINO ACID KYOTO YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 1984-04-10 — — US disclosed
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