SCHEMBL9755499

SCHEMBL9755499

CC1=C(C(=O)O)N2C(=O)[C@H](Br)[C@@H]2S(=O)(=O)C1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ELANE P08246 19/20 0.50
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33

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
SCHEMBL9755497 1.00 ELANE (0.50) ELANECACNA1BAPBA1
SCHEMBL7271996 0.82 ELANE (0.72) ELANE
SCHEMBL7351285 0.82 ELANE (0.72) ELANE
SCHEMBL7271999 0.82 ELANE (0.72) ELANE
SCHEMBL8670544 0.81 ELANE (0.72) ELANE
SCHEMBL8670547 0.81 ELANE (0.72) ELANE
SCHEMBL7271427 0.79 ELANE (0.74) ELANE
SCHEMBL9348324 0.79 ELANE (0.74) ELANE
SCHEMBL7271431 0.79 ELANE (0.74) ELANE
SCHEMBL7271423 0.79 ELANE (0.74) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991004977-A1 NOVEL 2-SPIROCYCLOPROPYL CEPHALOSPORIN SULFONE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF SYNPHAR LABORATORIES, INC. (CA) 1991-04-18 WO disclosed