SCHEMBL7272196

SCHEMBL7272196

CC(C)C[C@H](NC(=O)C1CC(=O)CC1(C)C)C(=O)N1CCC[C@H]1C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ CTSB P07858 1/20 0.42
▸ TRHR P34981 3/20 0.41

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
SCHEMBL7272470 0.90 TRHR (0.42) CAPN1TRHR
SCHEMBL7273516 0.89 TRHR (0.42) TRHR
SCHEMBL7273642 0.87 TRHR (0.41) TRHR
SCHEMBL7273636 0.87 ACE (0.42) TRHR
SCHEMBL7281074 0.86 ACE (0.44) TRHR
SCHEMBL7273752 0.85 ELANE (0.41) KMT2AMEN1
SCHEMBL7271566 0.84 OPRM1 (0.53) TRHR
SCHEMBL7271679 0.84 CAPN1 (0.40) CAPN1KMT2AMEN1CTSBTRHR
SCHEMBL7271688 0.84 CAPN1 (0.40) CAPN1KMT2AMEN1CTSBTRHR
SCHEMBL7280675 0.83 KMT2A (0.45) KMT2ATRHR

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 4 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 claimed
EP-0473993-A2 Novel peptide derivatives and their pharmaceutical use Japan Tobacco Inc. (JP) 1992-03-11 — — EP claimed
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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