SCHEMBL1592263

SCHEMBL1592263

C=C(C(=O)OCc1ccccc1)C(Br)(Br)Br

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
TDP1 Q9NUW8 2/20 0.50
KMT2A Q03164 2/20 0.50
MAPK1 P28482 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A3 Q01959 1/20 0.50
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HCAR2 Q8TDS4 1/20 0.46
TSHR P16473 2/20 0.45
MMP1 P03956 1/20 0.44
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP12 P39900 1/20 0.44
HTT P42858 1/20 0.44
MEN1 O00255 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42

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
SCHEMBL2833900 0.84 ALDH1A1 (0.50) ALDH1A1TDP1KMT2AMAPK1L3MBTL1
SCHEMBL18287624 0.84 ALDH1A1 (0.55) ALDH1A1TDP1KMT2AMAPK1L3MBTL1
SCHEMBL19185364 0.84 ALDH1A1 (0.55) ALDH1A1TDP1KMT2AMAPK1L3MBTL1
SCHEMBL10791920 0.83 KMT2A (0.50) ALDH1A1TDP1KMT2AMAPK1L3MBTL1
SCHEMBL10428945 0.81 ALDH1A1 (0.55) ALDH1A1TDP1KMT2AMAPK1L3MBTL1
SCHEMBL8767248 0.81 ALDH1A1 (0.59) ALDH1A1TDP1KMT2AMAPK1L3MBTL1
SCHEMBL2678884 0.81 ALDH1A1 (0.59) ALDH1A1TDP1KMT2AMAPK1L3MBTL1
SCHEMBL27144 0.80 ALDH1A1 (0.68) ALDH1A1TDP1KMT2AMAPK1L3MBTL1
SCHEMBL27561743 0.79 ALDH1A1 (0.57) ALDH1A1TDP1KMT2AMAPK1L3MBTL1
Chloromethane SCHEMBL28273315 0.79 ALDH1A1 (0.61) ALDH1A1TDP1KMT2AMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2328719-B1 ABRASIVE MATERIAL PRODUCT, ITS PRODUCTION METHOD AND USE METHOD 3M INNOVATIVE PROPERTIES CO (US) 2021-02-24 EP disclosed
US-9919406-B2 Abrasive material product, its production method and use method 3M INNOVATIVE PROPERTIES COMPANY (US) 2018-03-20 US disclosed
EP-2328719-A2 ABRASIVE MATERIAL PRODUCT, ITS PRODUCTION METHOD AND USE METHOD 3M Innovative Properties Company (US) 2011-06-08 EP disclosed
US-20110092137-A1 ABRASIVE MATERIAL PRODUCT, ITS PRODUCTION METHOD AND USE METHOD 3M INNOVATIVE PROPERTIES COMPANY 2011-04-21 US disclosed
WO-2010011801-A2 ABRASIVE MATERIAL PRODUCT, ITS PRODUCTION METHOD AND USE METHOD 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-01-28 WO disclosed