SCHEMBL9341044

SCHEMBL9341044

CCCC[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)OC

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BIRC2 Q13490 3/20 0.57
▸ DPP7 Q9UHL4 7/20 0.50
▸ DPP8 Q6V1X1 6/20 0.50
▸ DPP9 Q86TI2 6/20 0.50
▸ DPP4 P27487 3/20 0.50
▸ SLC15A1 P46059 1/20 0.50
▸ FOLH1 Q04609 1/20 0.49
▸ NPY4R P50391 2/20 0.46
▸ NPY1R P25929 1/20 0.46
▸ TAS1R3 Q7RTX0 2/20 0.45
▸ TAS1R1 Q7RTX1 2/20 0.45
▸ ERAP2 Q6P179 1/20 0.43
▸ LNPEP Q9UIQ6 1/20 0.43

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
SCHEMBL26292085 0.91 BIRC2 (0.53) BIRC2DPP7DPP8DPP9DPP4
SCHEMBL9345744 0.91 BIRC2 (0.53) BIRC2DPP7DPP8DPP9DPP4
SCHEMBL7324513 0.88 BIRC2 (0.51) BIRC2DPP7DPP8DPP9DPP4
SCHEMBL8811612 0.88 DPP7 (0.55) DPP7DPP8DPP9DPP4SLC15A1
SCHEMBL8811607 0.88 DPP7 (0.55) DPP7DPP8DPP9DPP4SLC15A1
SCHEMBL30558302 0.85 SLC15A1 (0.53) DPP7DPP8DPP9DPP4SLC15A1
SCHEMBL22199683 0.85 SLC15A1 (0.53) BIRC2DPP7DPP8DPP9DPP4
SCHEMBL31754261 0.85 DPP7 (0.53) BIRC2DPP7DPP8DPP9DPP4
SCHEMBL24049286 0.84 BIRC2 (0.54) BIRC2FOLH1TAS1R3TAS1R1
SCHEMBL11214006 0.84 BIRC2 (0.54) BIRC2FOLH1TAS1R3TAS1R1

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
EP-0604416-A1 IDENTIFYING MEMBRANOLYTIC COMPOUNDS AND PRECURSORS THEREOF THE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1994-07-06 — — EP disclosed
WO-1993005394-A1 IDENTIFYING MEMBRANOLYTIC COMPOUNDS AND PRECURSORS THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1993-03-18 — — WO disclosed
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