Sugi Predict

Sugi Predict / Compounds / SCHEMBL9435994

SCHEMBL9435994

SCHEMBL9435994

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

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 20/20 0.72
▸ CTSG P08311 1/20 0.57

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
SCHEMBL7859147 1.00 ELANE (0.72) ELANECTSG
SCHEMBL23777549 1.00 ELANE (0.72) ELANECTSG
SCHEMBL18880034 0.94 ELANE (0.68) ELANECTSG
SCHEMBL17378379 0.93 ELANE (0.68) ELANECTSG
SCHEMBL18880033 0.92 ELANE (0.68) ELANECTSG
SCHEMBL7284014 0.87 ELANE (0.91) ELANECTSG
SCHEMBL7437294 0.87 ELANE (0.71) ELANECTSG
SCHEMBL10577567 0.86 ELANE (0.71) ELANECTSG
SCHEMBL7285001 0.86 ELANE (0.66) ELANE
SCHEMBL23969653 0.86 ELANE (0.64) 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
EP-0589937-A1 USE OF 4-(4-CHLOROPHENYL-SULPHONYLCARBAMOYL) BENZOYL-L-VALYL-L-PROLINE 1($i(RS))-(1-TRIFLUOROACETYL-2-METHYLPROPYL) AMIDE IN THE TREATMENT OF VASCULAR DISEASES ZENECA LIMITED (GB) 1994-04-06 — — EP disclosed
WO-1992022309-A1 USE OF 4-(4-CHLOROPHENYL-SULPHONYLCARBAMOYL) BENZOYL-L-VALYL-L-PROLINE 1(RS)-(1-TRIFLUOROACETYL-2-METHYLPROPYL) AMIDE IN THE TREATMENT OF VASCULAR DISEASES ZENECA LTD. (GB) 1992-12-23 — — WO disclosed