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Sugi Predict / Compounds / SCHEMBL7966452

SCHEMBL7966452

SCHEMBL7966452

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

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 3/20 0.41
▸ CMA1 P23946 14/20 0.41
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CTSK P43235 2/20 0.37
▸ CTSL P07711 1/20 0.37
▸ CTSB P07858 1/20 0.37
▸ CTSS P25774 1/20 0.37
▸ CTRC Q99895 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
SCHEMBL8510794 0.94 ELANE (0.41) ELANECMA1MEN1KMT2ACTSK
SCHEMBL7860595 0.92 ELANE (0.46) ELANECMA1CTSKCTSLCTSB
SCHEMBL7330747 0.92 ELANE (0.39) ELANECMA1MEN1KMT2ACTSK
SCHEMBL7329397 0.91 ELANE (0.39) ELANECMA1MEN1KMT2ACTSK
SCHEMBL7964797 0.85 ELANE (0.44) ELANECMA1
SCHEMBL7960590 0.84 ELANE (0.40) ELANE
SCHEMBL7860728 0.83 ELANE (0.41) ELANECMA1MEN1KMT2ACTRC
SCHEMBL7881751 0.82 CTSL (0.43) ELANECMA1MEN1KMT2ACTSK
SCHEMBL7853825 0.82 ELANE (0.39) ELANECMA1MEN1KMT2ACTSK
SCHEMBL7952508 0.80 ELANE (0.48) ELANECMA1MEN1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6265381-B1 MORPHOLINOUREA AND RELATED DERIVATIVES OF PENTAFLUOROETHYL PEPTIDES MERRELL PHARMACEUTICALS, INC. 2001-07-24 — — US disclosed