SCHEMBL4026897

SCHEMBL4026897

COc1ccccc1COCCCOc1ccc([C@@H]2[C@@H](OCCOS(=O)(=O)c3ccc(C)cc3)CN(C(=O)O)C[C@H]2O[SiH2]CCCS)cc1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.41
RAB9A P51151 1/20 0.35

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
SCHEMBL4026891 0.92 REN (0.40) RENRAB9A
SCHEMBL1039331 0.85 REN (0.41) REN
SCHEMBL3082328 0.84 REN (0.44) REN
SCHEMBL3069390 0.80 REN (0.42) REN
SCHEMBL3079394 0.80 REN (0.41) REN
SCHEMBL1040823 0.78 REN (0.42) REN
SCHEMBL3073211 0.78 REN (0.42) REN
SCHEMBL6041721 0.76 REN (0.53) REN
SCHEMBL6041727 0.76 REN (0.53) REN
SCHEMBL3078335 0.76 RAB9A (0.36) RENRAB9A

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-2049514-A1 NITRATE ESTERS OF PIPERIDINES Speedel Experimenta AG (CH) 2009-04-22 EP disclosed
WO-2008017685-A1 NITRATE ESTERS OF PIPERIDINES SPEEDEL EXPERIMENTA AG (CH) 2008-02-14 WO disclosed