SCHEMBL6432428

SCHEMBL6432428

CCCCCCCCCCCCCCC(c1ccc(OC)cc1)C(c1ccc(OC)cc1)(c1ccc(OC)cc1)c1ccc(OC)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.43
MMP13 P45452 5/20 0.41
MMP9 P14780 4/20 0.41
ADAM17 P78536 4/20 0.41
MMP1 P03956 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MMP2 P08253 1/20 0.40
MMP3 P08254 1/20 0.40
ALDH1A1 P00352 2/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
FAAH O00519 1/20 0.36

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
SCHEMBL6745039 0.83 ALDH1A1 (0.50) MEN1KMT2AALDH1A1TDP1
SCHEMBL6747067 0.83 ALDH1A1 (0.50) MEN1KMT2AALDH1A1TDP1
SCHEMBL8018667 0.81 SLC2A1 (0.39) SLC2A1MMP13MMP9ADAM17MMP1
SCHEMBL6744267 0.81 ALDH1A1 (0.51) MEN1KMT2AALDH1A1TDP1
SCHEMBL8018671 0.79 MMP9 (0.39) SLC2A1MMP13MMP9ADAM17MMP1
SCHEMBL27886667 0.79 MEN1 (0.42) MMP9MMP1MEN1KMT2AMMP2
SCHEMBL14768367 0.79 MEN1 (0.42) MMP9MMP1MEN1KMT2AMMP2
SCHEMBL3217271 0.78 SLC2A1 (0.49) SLC2A1MMP13MMP9ADAM17MMP1
SCHEMBL25620259 0.78 SLC2A1 (0.49) SLC2A1MMP13MMP9ADAM17MMP1
SCHEMBL25620258 0.78 SLC2A1 (0.49) SLC2A1MMP13MMP9ADAM17MMP1

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-1539127-A1 METHOD OF TREATING OSTEOARTHRITIS WARNER-LAMBERT COMPANY LLC (US) 2005-06-15 EP disclosed
WO-2004017952-A1 METHOD OF TREATING OSTEOARTHRITIS WARNER-LAMBERT COMPANY LLC (US) 2004-03-04 WO disclosed