SCHEMBL27675720

SCHEMBL27675720

Oc1cccc(O)c1OC(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.40
RAB9A P51151 2/20 0.40
MEN1 O00255 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
CA2 P00918 5/20 0.39
HPGD P15428 4/20 0.39
ALOX15 P16050 4/20 0.39
HSD17B10 Q99714 4/20 0.39
CA1 P00915 4/20 0.39
ALDH1A1 P00352 3/20 0.39
LMNA P02545 3/20 0.39
RECQL P46063 3/20 0.39
TDP1 Q9NUW8 3/20 0.39
EGFR P00533 2/20 0.39
FYN P06241 2/20 0.39
MMP9 P14780 2/20 0.39
ADAMTS4 O75173 1/20 0.39
MMP2 P08253 1/20 0.39
MMP8 P22894 1/20 0.39

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
SCHEMBL2094188 0.87 MAPT (0.39) MAPTRAB9AMEN1HTTKMT2A
SCHEMBL2093299 0.87 MAPT (0.36) MAPTRAB9AMEN1HTTKMT2A
SCHEMBL24181283 0.85 TRPA1 (0.50) MAPTRAB9AMEN1HTTKMT2A
SCHEMBL27841630 0.85 MAPT (0.35) MAPTRAB9AMEN1HTTKMT2A
SCHEMBL2091798 0.85 TSHR (0.45) MAPTRAB9AMEN1HTTKMT2A
SCHEMBL16959166 0.83 CA2 (0.42) MAPTRAB9AMEN1HTTKMT2A
SCHEMBL16961273 0.82 MEN1 (0.34) MAPTRAB9AMEN1HTTKMT2A
SCHEMBL16959167 0.82 MAPT (0.43) MAPTRAB9AMEN1HTTKMT2A
SCHEMBL29951567 0.82 CA1 (0.37) MAPTRAB9AMEN1HTTKMT2A
SCHEMBL24436839 0.82 TP53 (0.53) MAPTRAB9AMEN1KMT2ACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101815707-B oxadiazole diaryl compounds MERCK SERONO S.A. (CH) 2015-09-02 CN disclosed
CN-102993084-B Alkynyl derivatives as modulators of metabotropic glutamate receptors ADDEX PHARMACEUTICALS SA 2015-05-20 CN disclosed
CN-104478821-A Oxadiazole diaryl compounds MERCK SERONO SA 2015-04-01 CN disclosed
CN-102993084-A Alkynyl derivatives as modulators of metabotropic glutamate receptors ADDEX PHARMACEUTICALS SA 2013-03-27 CN disclosed
CN-101001846-B Alkynyl derivatives as modulators of metabotropic glutamate receptors ADDEX PHARMACEUTICALS SA 2012-11-07 CN disclosed
CN-101815707-A oxadiazole diaryl compounds MERCK SERONO SA 2010-08-25 CN disclosed
CN-101001846-A Novel alkynyl derivatives as modulators of metabotropic glutamate receptors ADDEX PHARMACEUTICALS SA (CH) 2007-07-18 CN disclosed