SCHEMBL6972429

SCHEMBL6972429

[O]S(=O)(=O)c1ccccc1OC(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.47
SLC22A12 Q96S37 4/20 0.46
SLC40A1 Q9NP59 1/20 0.46
PTGES2 Q9H7Z7 1/20 0.43
HTR6 P50406 2/20 0.42
ELANE P08246 1/20 0.41
KDM2B Q8NHM5 1/20 0.41
CNR2 P34972 2/20 0.40
BRD4 O60885 1/20 0.40
RORC P51449 1/20 0.38
AKR1C3 P42330 1/20 0.38
CHRM1 P11229 1/20 0.38
GAA P10253 1/20 0.37

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
SCHEMBL3528957 0.84 ELANE (0.60) ALPLSLC22A12SLC40A1PTGES2HTR6
SCHEMBL692280 0.82 PTGES2 (0.55) ALPLSLC22A12SLC40A1PTGES2HTR6
SCHEMBL122293 0.82 SLC22A12 (0.48) ALPLSLC22A12SLC40A1PTGES2HTR6
SCHEMBL29520001 0.82 SLC22A12 (0.48) ALPLSLC22A12SLC40A1PTGES2HTR6
SCHEMBL2646108 0.82 ALPL (0.46) ALPLSLC22A12SLC40A1PTGES2HTR6
SCHEMBL645001 0.82 ALPL (0.46) ALPLSLC22A12SLC40A1PTGES2HTR6
SCHEMBL6039108 0.82 SLC22A12 (0.48) ALPLSLC22A12SLC40A1PTGES2HTR6
SCHEMBL10646541 0.82 SLC22A12 (0.48) ALPLSLC22A12SLC40A1PTGES2HTR6
SCHEMBL29469931 0.82 PTGES2 (0.55) ALPLSLC22A12SLC40A1PTGES2HTR6
SCHEMBL6627180 0.81 ELANE (0.47) ALPLSLC22A12HTR6ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed