SCHEMBL7917074

SCHEMBL7917074

O=C(O)c1c(F)c(S(=O)(=O)O)c(C(=O)O)c(F)c1S(=O)(=O)O

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
MMP13 P45452 1/20 0.31
CYP2D6 P10635 1/20 0.31
CA12 O43570 1/20 0.31
CA7 P43166 1/20 0.31
CA13 Q8N1Q1 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
SCHEMBL9405062 0.91 CA1 (0.40) CA1CA2LCKFYNMMP1
SCHEMBL7738469 0.90 CA1 (0.34) CA1CA2LCKFYNMMP1
SCHEMBL5014329 0.89 CA1 (0.39) CA1CA2LCKFYNMMP1
SCHEMBL7074393 0.83 CA1 (0.37) CA1CA2LCKFYNMMP1
SCHEMBL21800805 0.78 LCK (0.39) CA1CA2LCKFYNCYP2D6
SCHEMBL6956419 0.78 CYP3A4 (0.32)
SCHEMBL27724699 0.76 CA12 (0.30) CA1CA2CA12CA7CA13
SCHEMBL11174351 0.76 LCK (0.37) CA1CA2LCKFYNCYP2D6
SCHEMBL21800804 0.74 LCK (0.36) CA1CA2LCKFYNCYP2D6
SCHEMBL3764978 0.73 CA1 (0.37) CA1CA2MMP1MMP2MMP9

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
US-6248480-B1 High temperature polymer electrolytes SRI INTERNATIONAL 2001-06-19 US disclosed
WO-2001001510-A1 HIGH TEMPERATURE POLYMER ELECTROLYTES SRI INTERNATIONAL (US) 2001-01-04 WO disclosed