SCHEMBL7273752

SCHEMBL7273752

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

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 13/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ DPP4 P27487 1/20 0.38
▸ DPP8 Q6V1X1 1/20 0.38
▸ DPP9 Q86TI2 1/20 0.38
▸ XIAP P98170 1/20 0.37

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
SCHEMBL7271688 0.93 CAPN1 (0.40) ELANEMEN1KMT2AXIAP
SCHEMBL7271679 0.93 CAPN1 (0.40) ELANEMEN1KMT2AXIAP
SCHEMBL7280675 0.90 KMT2A (0.45) ELANEKMT2AXIAP
SCHEMBL7280679 0.90 KMT2A (0.45) ELANEKMT2AXIAP
SCHEMBL7272196 0.85 CAPN1 (0.43) MEN1KMT2A
SCHEMBL7272470 0.84 TRHR (0.42) —
SCHEMBL7273516 0.84 TRHR (0.42) —
SCHEMBL7273642 0.82 TRHR (0.41) —
SCHEMBL7273636 0.81 ACE (0.42) —
SCHEMBL7281074 0.81 ACE (0.44) —

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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