SCHEMBL1508205

SCHEMBL1508205

[O-][S+](C(c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1)C(c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 3/20 0.38
RAB9A P51151 2/20 0.37
USP2 O75604 1/20 0.37
CYP19A1 P11511 2/20 0.34
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
HSD11B1 P28845 1/20 0.33
ACHE P22303 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
XBP1 P17861 1/20 0.31
MAPK1 P28482 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
SCHEMBL1508214 0.80 ACHE (0.36) KCNN4RAB9AUSP2CYP19A1CA1
SCHEMBL1508127 0.80 KCNN4 (0.40) KCNN4RAB9AUSP2CYP19A1CA1
SCHEMBL1508050 0.75 HSD11B1 (0.33) KCNN4RAB9AUSP2HSD11B1ACHE
SCHEMBL1508035 0.75 HSD11B1 (0.33) KCNN4RAB9AUSP2CA1CA2
SCHEMBL1508204 0.73 MAPK1 (0.37) KCNN4RAB9AUSP2CA1CA2
SCHEMBL1507934 0.73 KCNN4 (0.39) KCNN4RAB9AUSP2NPC1MAPT
SCHEMBL1507912 0.69 NPC1 (0.37) RAB9ACYP19A1HSD11B1NPC1KMT2A
SCHEMBL14066322 0.69 KCNN4 (0.40) KCNN4SMN1; SMN2MEN1MAPTMAPK1
SCHEMBL1507904 0.69 KMT2A (0.37) KCNN4RAB9AACHESMN1; SMN2MEN1
SCHEMBL1507940 0.69 KCNN4 (0.40) KCNN4RAB9ASMN1; SMN2MEN1NPC1

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-2292595-A1 Potassium channel modulators NeuroSearch AS (DK) 2011-03-09 EP disclosed