SCHEMBL1744872

SCHEMBL1744872

O=C(O)n1cc(-c2cc(Cl)c(F)cc2O)cn1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLAU P00749 3/20 0.37
ELANE P08246 3/20 0.37
FFAR1 O14842 1/20 0.35
F2 P00734 1/20 0.35
KLKB1 P03952 1/20 0.35
EGLN1 Q9GZT9 1/20 0.34
MET P08581 1/20 0.33
XDH P47989 1/20 0.33
SLC22A12 Q96S37 1/20 0.33
ALPL P05186 1/20 0.33
RIPK2 O43353 1/20 0.32
KMO O15229 2/20 0.32
KCNH2 Q12809 1/20 0.32
PIK3CA P42336 1/20 0.32

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
SCHEMBL1094722 0.81 SCN9A (0.46) PLAUELANEFFAR1MET
SCHEMBL1094641 0.80 CA1 (0.44) KMO
SCHEMBL2821693 0.75 ACMSD (0.42) PLAUELANE
SCHEMBL28710155 0.69 BCL2L1 (0.46) PLAUELANEF2KLKB1EGLN1
SCHEMBL28700571 0.69 MAP4K4 (0.50) PLAUELANEF2KLKB1EGLN1
SCHEMBL28705422 0.68 EGLN1 (0.50) EGLN1KMO
SCHEMBL28710160 0.68 KMO (0.42) EGLN1KMO
SCHEMBL15231450 0.68 S1PR1 (0.37) PLAUELANEFFAR1KMO
SCHEMBL28696544 0.66 CREBBP (0.40) PLAUELANEEGLN1
SCHEMBL28712265 0.66 ORAI1 (0.38) PLAUELANEALPL

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-2385938-A1 SULFONAMIDE DERIVATIVES Pfizer Limited (GB) 2011-11-16 EP disclosed
US-8040476-B2 Display device and method of producing the same MITSUBISHI ELECTRIC CORPORATION (JP) 2011-10-18 US disclosed
WO-2010079443-A1 SULFONAMIDE DERIVATIVES PFIZER LIMITED (GB) 2010-07-15 WO disclosed