SCHEMBL725765

SCHEMBL725765

CC(C)(C(=O)c1ccc(SCC(=O)O)cc1)N1CCOCC1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.69
ALDH1A1 P00352 5/20 0.69
MAPK1 P28482 2/20 0.69
TSHR P16473 1/20 0.69
FKBP1A P62942 4/20 0.48
RAB9A P51151 3/20 0.48
TP53 P04637 2/20 0.48
HRH3 Q9Y5N1 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CTSB P07858 1/20 0.43
ELANE P08246 1/20 0.43
DUSP3 P51452 1/20 0.43
FFAR1 O14842 1/20 0.41
MAPT P10636 2/20 0.41
GAA P10253 1/20 0.40
NPC1 O15118 1/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.38

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
Hydrochloric Acid SCHEMBL725583 0.99 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1MAPK1TSHRFKBP1A
SCHEMBL725582 0.88 ALDH1A1 (0.67) SMN1; SMN2ALDH1A1MAPK1TSHRFKBP1A
SCHEMBL10883782 0.88 SMN1; SMN2 (0.74) SMN1; SMN2ALDH1A1MAPK1TSHRFKBP1A
SCHEMBL10886078 0.88 SMN1; SMN2 (0.74) SMN1; SMN2ALDH1A1MAPK1TSHRFKBP1A
SCHEMBL10887655 0.87 ALDH1A1 (0.66) SMN1; SMN2ALDH1A1MAPK1TSHRFKBP1A
SCHEMBL10891130 0.87 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1MAPK1TSHRFKBP1A
SCHEMBL10890742 0.87 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1MAPK1TSHRFKBP1A
SCHEMBL6674533 0.86 SMN1; SMN2 (0.72) SMN1; SMN2ALDH1A1MAPK1TSHRFKBP1A
SCHEMBL21753835 0.86 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1MAPK1TSHRFKBP1A
SCHEMBL727076 0.86 ALDH1A1 (0.64) SMN1; SMN2ALDH1A1MAPK1TSHRFKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2585431-B1 METAL FREE BLEACHING COMPOSITION BASF SE (DE) 2017-09-06 EP disclosed
US-9657435-B2 Metal free bleaching composition BASF SE (DE) 2017-05-23 US disclosed
US-9657435-B2 Metal free bleaching composition BASF SE (DE) 2017-05-23 US disclosed
US-20130117941-A1 METAL FREE BLEACHING COMPOSITION BASF SE (DE) 2013-05-16 US disclosed
US-20130117941-A1 METAL FREE BLEACHING COMPOSITION BASF SE (DE) 2013-05-16 US disclosed
EP-2585431-A1 METAL FREE BLEACHING COMPOSITION BASF SE (DE) 2013-05-01 EP disclosed
WO-2012000846-A1 METAL FREE BLEACHING COMPOSITION BASF SE (DE) 2012-01-05 WO disclosed
WO-2012000846-A1 METAL FREE BLEACHING COMPOSITION BASF SE (DE) 2012-01-05 WO disclosed
US-7875698-B2 comprising dendritic polymer core of hyperbranched polyglycidol; for use in radiation curable varnishes, lacquers, printing inks, and inkjet inks AGFA GRAPHICS NV (BE) 2011-01-25 US disclosed
US-7875698-B2 comprising dendritic polymer core of hyperbranched polyglycidol; for use in radiation curable varnishes, lacquers, printing inks, and inkjet inks AGFA GRAPHICS NV (BE) 2011-01-25 US disclosed
US-7795324-B2 Radiation curable compositions AGFA GRAPHICS, N.V. (BE) 2010-09-14 US disclosed
US-7795324-B2 Radiation curable compositions AGFA GRAPHICS, N.V. (BE) 2010-09-14 US disclosed
US-4582862-A QUICK-SETTING PRINTING INKS BASED ON ACRYLATED RESINS CIBA-GEIGY CORPORATION (US) 1986-04-15 US disclosed