SCHEMBL7282397

SCHEMBL7282397

CC(O)[C@H](NC(=O)C1CCC(=O)C1)C(=O)N1CCC[C@H]1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 2/20 0.41
▸ CTSB P07858 1/20 0.41
▸ TRHR P34981 4/20 0.40
▸ SLC6A2 P23975 1/20 0.37
▸ ELANE P08246 2/20 0.36

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
SCHEMBL7282406 1.00 CAPN1 (0.41) CAPN1CTSBTRHRSLC6A2ELANE
SCHEMBL7273990 0.92 ELANE (0.43) TRHRELANE
SCHEMBL7285431 0.89 XIAP (0.46) TRHR
SCHEMBL7285438 0.89 XIAP (0.46) TRHR
SCHEMBL7443716 0.86 CAPN1 (0.40) CAPN1CTSBTRHRSLC6A2ELANE
SCHEMBL7443723 0.86 CAPN1 (0.40) CAPN1CTSBTRHRSLC6A2ELANE
SCHEMBL7271564 0.83 TRHR (0.47) CAPN1CTSBTRHR
SCHEMBL7281202 0.82 CAPN1 (0.41) CAPN1CTSBTRHRSLC6A2ELANE
SCHEMBL7281210 0.82 CAPN1 (0.41) CAPN1CTSBTRHRSLC6A2ELANE
SCHEMBL7273117 0.81 TRHR (0.47) CAPN1TRHR

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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