SCHEMBL2331289

SCHEMBL2331289

O=C(NCC1(F)CCNCC1)OC(c1nccc(C(F)(F)F)n1)c1cc(C(=O)O)no1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 2/20 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
SCHEMBL344924 0.91 SYK (0.35) IRAK4
SCHEMBL2327815 0.75 CHRM1 (0.36)
SCHEMBL2324598 0.69 CHRM1 (0.35)
SCHEMBL2331284 0.69 ADRB1 (0.40)
SCHEMBL345079 0.67 MAPT (0.36)
SCHEMBL2329304 0.66 TACR1 (0.30)
SCHEMBL346214 0.64 SLC6A2 (0.37)
Trifluoroacetic Acid SCHEMBL345531 0.61 KMT2A (0.34)
SCHEMBL344922 0.61 ADRB1 (0.38)
SCHEMBL1728758 0.60 ADRB1 (0.40)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2356108-B1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-10-15 EP disclosed
EP-2356108-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-08-17 EP disclosed
WO-2010055267-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-05-20 WO disclosed