Sugi Predict

Sugi Predict / Compounds / SCHEMBL7368741

SCHEMBL7368741

SCHEMBL7368741

CC(C)[C@H](NC(=O)c1ccc(C(=O)NS(=O)(=O)c2ccc(Cl)cc2)cc1)C(=O)N1CCC[C@H]1C(=O)OC(C)(C)C

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 18/20 0.65
▸ STS P08842 1/20 0.45

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
SCHEMBL7285001 0.88 ELANE (0.66) ELANE
SCHEMBL9435994 0.84 ELANE (0.72) ELANE
SCHEMBL7859147 0.84 ELANE (0.72) ELANE
SCHEMBL23777549 0.84 ELANE (0.72) ELANE
SCHEMBL23969653 0.83 ELANE (0.64) ELANE
SCHEMBL23969612 0.83 ELANE (0.64) ELANE
SCHEMBL10573052 0.82 ELANE (0.51) ELANE
SCHEMBL23969623 0.82 ELANE (0.59) ELANE
SCHEMBL22209505 0.82 CCR1 (0.54) ELANE
SCHEMBL18621674 0.82 CCR1 (0.54) ELANE

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
US-5164371-A HETEROCYCLIC KETONES ICI AMERICAS INC. (US) 1992-11-17 — — US disclosed
EP-0291234-A2 Peptidic human leukocyte elastase (HLE) inhibitors ZENECA INC. (US) 1988-11-17 — — EP disclosed