SCHEMBL16680208

SCHEMBL16680208

CS(=O)(=O)Oc1ccc(I)cc1Br

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
KMT2A Q03164 1/20 0.35
CYP1A2 P05177 1/20 0.35
ALPL P05186 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA9 Q16790 3/20 0.34
ALDH1A1 P00352 2/20 0.33
EPAS1 Q99814 2/20 0.33
PTPN1 P18031 2/20 0.33
CTSL P07711 1/20 0.33
MCOLN3 Q8TDD5 1/20 0.33
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PDE4B Q07343 1/20 0.32
PTGS2 P35354 1/20 0.31
STS P08842 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
SCHEMBL31444138 0.81 ELANE (0.39) CA1CA2CA9ALDH1A1EPAS1
SCHEMBL16679995 0.81 KDM4E (0.37) KDM4EKMT2ACYP1A2ALPLTSHR
SCHEMBL11568855 0.78 PKM (0.47) KDM4EKMT2ACYP1A2ALPLTSHR
SCHEMBL936370 0.78 KDM4E (0.35) KDM4EKMT2ACYP1A2ALPLTSHR
SCHEMBL16679889 0.78 EPAS1 (0.43) KDM4EKMT2ACYP1A2TSHRALDH1A1
SCHEMBL936003 0.75 EPAS1 (0.43) KDM4EKMT2ATSHRALDH1A1EPAS1
SCHEMBL12909005 0.75 MCOLN3 (0.43) KDM4EKMT2ATSHRHSD17B10ALDH1A1
SCHEMBL14872780 0.74 CA1 (0.37) KDM4EKMT2ACYP1A2ALPLTSHR
SCHEMBL2498828 0.74 ALDH1A1 (0.52) KMT2ACYP1A2ALDH1A1MCOLN3MAPK1
SCHEMBL28307636 0.74 RAD51 (0.33) KDM4EKMT2ACYP1A2ALPLTSHR

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
US-10683244-B2 Method for controlling plant parasitic nematodes YAMASHITA THOMAS T (US) 2020-06-16 US disclosed
US-20190023627-A1 Compositions for Controlling Plant Parasitic Nematodes and Methods for Using Same YAMASHITA THOMAS T (US) 2019-01-24 US disclosed
US-10106472-B2 Compositions for controlling plant parasitic nematodes and methods for using same YAMASHITA THOMAS T (US) 2018-10-23 US disclosed
US-20170226024-A1 Compositions for Controlling Plant Parasitic Nematodes and Methods for Using Same YAMASHITA THOMAS T (US) 2017-08-10 US disclosed
US-9661857-B2 Compositions for controlling plant parasitic nematodes YAMASHITA THOMAS T (US) 2017-05-30 US disclosed
US-20150125435-A1 Compositions for Controlling Plant Parasitic Nematodes and Methods for Using Same YAMASHITA THOMAS T (US) 2015-05-07 US disclosed