SCHEMBL15219645

SCHEMBL15219645

O=C(Nc1ccccc1)Nc1ccc(NC(=O)Nc2ccccc2)c(S(=O)(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNJ6 P48051 1/20 0.55
KCNJ5 P48544 1/20 0.55
KCNJ3 P48549 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.53
TP53 P04637 1/20 0.53
EPHX1 P07099 1/20 0.53
TSHR P16473 1/20 0.53
EPHX2 P34913 1/20 0.53
CDK9 P50750 1/20 0.53
CLK4 Q9HAZ1 1/20 0.53
MAPT P10636 4/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
HTT P42858 2/20 0.53
MEN1 O00255 1/20 0.53
LMNA P02545 1/20 0.53
KMT2A Q03164 1/20 0.53
ACP1 P24666 2/20 0.51
CASP3 P42574 1/20 0.51
SENP7 Q9BQF6 1/20 0.51

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
SCHEMBL15210456 0.98 KCNJ6 (0.53) KCNJ6KCNJ5KCNJ3SMN1; SMN2TP53
SCHEMBL16272362 0.91 NPC1 (0.59) KCNJ6KCNJ5KCNJ3SMN1; SMN2TP53
SCHEMBL15219449 0.88 GRIK1 (0.60) KCNJ6KCNJ5KCNJ3SMN1; SMN2TP53
SCHEMBL15210370 0.86 GRIK1 (0.59) KCNJ6KCNJ5KCNJ3SMN1; SMN2TP53
SCHEMBL15263537 0.85 TP53 (0.59) SMN1; SMN2TP53EPHX1TSHREPHX2
SCHEMBL15210455 0.85 MAPT (0.54) KCNJ6KCNJ5KCNJ3SMN1; SMN2TP53
SCHEMBL9321648 0.82 ENPP2 (0.74) KCNJ6KCNJ5KCNJ3SMN1; SMN2TP53
SCHEMBL14437899 0.82 ENPP2 (0.74) KCNJ6KCNJ5KCNJ3SMN1; SMN2TP53
SCHEMBL28964396 0.81 CA12 (0.59) KCNJ6KCNJ5KCNJ3MAPTNPC1
SCHEMBL17255098 0.81 ENPP2 (0.72) KCNJ6KCNJ5KCNJ3SMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2817402-B1 COLOR PROTECTION DETERGENT HENKEL AG & CO KGAA (DE) 2017-07-05 EP disclosed
US-8940681-B2 Color protection detergent HENKEL AG & CO. KGAA (DE) 2015-01-27 US disclosed
US-8940681-B2 Color protection detergent HENKEL AG & CO. KGAA (DE) 2015-01-27 US disclosed
US-20140352080-A1 COLOR PROTECTION DETERGENT HENKEL AG & CO. KGAA (DE) 2014-12-04 US disclosed
US-20140352080-A1 COLOR PROTECTION DETERGENT HENKEL AG & CO. KGAA (DE) 2014-12-04 US disclosed
WO-2013123981-A1 COLOR PROTECTION DETERGENT HENKEL AG & CO. KGAA (DE) 2013-08-29 WO disclosed