SCHEMBL18700968

SCHEMBL18700968

CCc1cccc(S(=O)(=O)O)c1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.41
GABRB2 P47870 2/20 0.41
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA14 Q9ULX7 1/20 0.38
MMP2 P08253 4/20 0.37
MMP8 P22894 4/20 0.37
MMP12 P39900 4/20 0.37
MMP13 P45452 4/20 0.37
MMP14 P50281 4/20 0.37
MMP16 P51512 4/20 0.37
TTR P02766 1/20 0.37
METAP2 P50579 2/20 0.37
CTSB P07858 1/20 0.37
MYC P01106 1/20 0.35
CYP1A2 P05177 1/20 0.35
MMP9 P14780 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MMP1 P03956 2/20 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
SCHEMBL1805298 0.88 TTR (0.40) CA12CA1CA2CA14MMP2
SCHEMBL1805297 0.88 CA12 (0.37) CA12CA1CA2CA14MMP2
SCHEMBL1808988 0.86 CA12 (0.36) CA12CA1CA2CA14MMP2
SCHEMBL1808990 0.86 CA12 (0.39) CA12CA1CA2CA14MMP2
SCHEMBL1803681 0.85 CA12 (0.44) CA12CA1CA2CA14MMP2
SCHEMBL1803682 0.85 CA12 (0.41) CA12CA1CA2CA14MMP2
SCHEMBL1806671 0.83 TAAR1 (0.45) CA12CA1CA2CA14TTR
SCHEMBL1806666 0.83 CA12 (0.40) CA12CA1CA2CA14MMP2
SCHEMBL28297316 0.82 CA2 (0.44) GABRA1GABRB2CA12CA1CA2
SCHEMBL668439 0.79 HTR6 (0.47) CA12CA1CA2CA14TTR

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
US-10365262-B2 Method of monitoring a parameter of a hydrocarbon well, pipeline or formation JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2019-07-30 US disclosed
US-20180284096-A1 METHOD OF MONITORING A PARAMETER OF A HYDROCARBON WELL, PIPELINE OR FORMATION TRACERCO LIMITED (GB) 2018-10-04 US disclosed
WO-2017060702-A1 METHOD OF MONITORING A PARAMETER OF A HYDROCARBON WELL, PIPELINE OR FORMATION JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2017-04-13 WO disclosed