SCHEMBL8567599

SCHEMBL8567599

CC(C)C(NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(=O)[C@H](C)N)C(=O)C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
XIAP P98170 1/20 0.56
ELANE P08246 18/20 0.56
CTSG P08311 1/20 0.47
CMA1 P23946 1/20 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
SCHEMBL8574659 1.00 XIAP (0.56) XIAPELANECTSGCMA1
SCHEMBL8630185 0.86 CMA1 (0.51) ELANECMA1
SCHEMBL8053347 0.83 ELANE (0.56) XIAPELANECTSGCMA1
SCHEMBL8053356 0.83 ELANE (0.56) XIAPELANECTSGCMA1
SCHEMBL17378387 0.80 ELANE (0.66) ELANECTSGCMA1
SCHEMBL29286208 0.80 ELANE (0.50) XIAPELANECTSGCMA1
SCHEMBL18880059 0.79 ELANE (0.64) ELANECTSGCMA1
SCHEMBL18880056 0.79 ELANE (0.64) ELANECTSGCMA1
SCHEMBL7552455 0.78 ELANE (0.63) ELANECTSGCMA1
SCHEMBL7374559 0.78 ELANE (0.63) ELANECTSGCMA1

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-5849866-A Peptidase inhibitors MERRELL PHARMACEUTICALS INC. (US) 1998-12-15 US disclosed