SCHEMBL7274041

SCHEMBL7274041

CC(C)[C@H](NC(=O)[C@@H]1CC(=O)C[C@@H]1C)C(=O)N1CCC[C@H]1C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 13/20 0.44
▸ DPP4 P27487 1/20 0.40
▸ DPP8 Q6V1X1 1/20 0.40
▸ DPP9 Q86TI2 1/20 0.40
▸ CMA1 P23946 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ XIAP P98170 1/20 0.38
▸ CTSG P08311 1/20 0.38

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
SCHEMBL7274032 1.00 ELANE (0.44) ELANEDPP4DPP8DPP9CMA1
SCHEMBL7281210 0.93 CAPN1 (0.41) ELANEXIAP
SCHEMBL7281202 0.93 CAPN1 (0.41) ELANEXIAP
SCHEMBL7276782 0.90 XIAP (0.46) ELANEKMT2AXIAP
SCHEMBL7276794 0.90 XIAP (0.46) ELANEKMT2AXIAP
SCHEMBL7273522 0.84 CAPN1 (0.44) MEN1KMT2A
SCHEMBL7443723 0.84 CAPN1 (0.40) ELANE
SCHEMBL7443716 0.84 CAPN1 (0.40) ELANE
SCHEMBL7282352 0.84 TRHR (0.43) —
SCHEMBL7282638 0.83 TRHR (0.43) —

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-0473993-B1 Novel peptide derivatives and their pharmaceutical use JAPAN TOBACCO INC (JP) 1996-04-17 — — EP disclosed
EP-0473993-A2 Novel peptide derivatives and their pharmaceutical use Japan Tobacco Inc. (JP) 1992-03-11 — — EP disclosed
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