SCHEMBL8764970

SCHEMBL8764970

O=S(=O)(CS(=O)(=O)C(F)(F)F)c1ccccc1OC(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.43
ALPL P05186 1/20 0.42
SLC22A12 Q96S37 4/20 0.41
SLC40A1 Q9NP59 1/20 0.41
BRD4 O60885 1/20 0.41
KDM2B Q8NHM5 1/20 0.40
PTGES2 Q9H7Z7 1/20 0.39
NAMPT P43490 1/20 0.38
PLCG1 P19174 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
TYK2 P29597 1/20 0.38
JAK3 P52333 1/20 0.38
RORC P51449 2/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
ELANE P08246 1/20 0.36
CNR2 P34972 1/20 0.35
LIPE Q05469 1/20 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
SCHEMBL21216562 0.83 HTR6 (0.48) HTR6ALPLSLC22A12SLC40A1BRD4
SCHEMBL2378222 0.81 HTR6 (0.44) HTR6ALPLSLC22A12SLC40A1BRD4
SCHEMBL4074736 0.78 SLC22A12 (0.49) HTR6ALPLSLC22A12SLC40A1BRD4
SCHEMBL3528957 0.77 ELANE (0.60) HTR6ALPLSLC22A12SLC40A1BRD4
SCHEMBL6972429 0.77 ALPL (0.47) HTR6ALPLSLC22A12SLC40A1BRD4
SCHEMBL14488968 0.76 HTR6 (0.44) HTR6ALPLSLC22A12SLC40A1BRD4
SCHEMBL8764342 0.76 HSD11B1 (0.45) PLCG1
SCHEMBL8763365 0.76 MEN1 (0.49) SLC22A12PLCG1
SCHEMBL645001 0.75 ALPL (0.46) HTR6ALPLSLC22A12SLC40A1BRD4
SCHEMBL2646108 0.75 ALPL (0.46) HTR6ALPLSLC22A12SLC40A1BRD4

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-0606756-B1 Use of disulfonyl methanes for the control of parasites LILLY CO ELI (US) 1997-07-23 EP claimed
US-5637603-A FORMULATION WHICH PROTECTS VERTEBRATE ANIMALS AGAINST PARASITES ELI LILLY AND COMPANY (US) 1997-06-10 US claimed
EP-0606756-A1 Use of disulfonyl methanes for the control of parasites ELI LILLY AND COMPANY (US) 1994-07-20 EP claimed