SCHEMBL23736034

SCHEMBL23736034

COC(=O)[C@@H]1CCCCOC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](N)C(=O)N1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.48
▸ CTSD P07339 2/20 0.43
▸ BACE1 P56817 2/20 0.34
▸ CPB2 Q96IY4 1/20 0.33
▸ REN P00797 2/20 0.33
▸ BTK Q06187 1/20 0.32
▸ PLG P00747 1/20 0.32
▸ NAAA Q02083 2/20 0.31
▸ TERF2 Q15554 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ NFKB2 Q00653 1/20 0.31
▸ RELA Q04206 1/20 0.31

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
SCHEMBL23736117 0.95 GAA (0.47) GAACTSDBACE1CPB2REN
SCHEMBL23736230 0.94 GAA (0.50) GAACTSDBACE1CPB2REN
SCHEMBL15727299 0.88 CTSD (0.53) GAACTSDBACE1RENTERF2
SCHEMBL23736092 0.84 CTSD (0.44) GAACTSDBACE1CPB2REN
SCHEMBL15727316 0.84 CTSD (0.53) GAACTSDBACE1NAAATERF2
SCHEMBL23736276 0.83 GAA (0.49) GAACTSDBACE1BTKPLG
SCHEMBL15727314 0.83 CTSD (0.55) GAACTSDBACE1TERF2
SCHEMBL23736282 0.82 GAA (0.47) GAACTSDBACE1PLGNFKB1
SCHEMBL23736270 0.81 KMT2A (0.32) —
SCHEMBL8290665 0.81 GAA (0.42) GAACTSDTERF2

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
EP-2922829-B1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS INC (US) 2021-08-11 — — EP disclosed
Send feedback