SCHEMBL2138262

SCHEMBL2138262

CCOC(=O)C1C=CC=CC1(CC)S(=O)(=O)NC(=O)Nc1nc(Cl)cc(OC)n1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.37
ALDH1A1 P00352 3/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CYP1A2 P05177 1/20 0.32
MAPT P10636 2/20 0.32
TP53 P04637 1/20 0.32
GLA P06280 1/20 0.32
LMNA P02545 1/20 0.32
CDK1 P06493 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL6642783 0.90 GAA (0.39) GAAALDH1A1TSHRSMN1; SMN2CYP1A2
SCHEMBL8587808 0.80 GAA (0.37) GAAALDH1A1TSHRSMN1; SMN2MAPT
SCHEMBL9369039 0.77 ADORA3 (0.31) GAA
SCHEMBL11098013 0.73 GAA (0.40) GAAALDH1A1TSHRSMN1; SMN2CYP1A2
SCHEMBL6313348 0.71 GAA (0.48) GAAALDH1A1TSHRSMN1; SMN2CYP1A2
SCHEMBL9823654 0.69 GAA (0.54) GAAALDH1A1TSHRSMN1; SMN2CYP1A2
SCHEMBL9065322 0.69 ALDH1A1 (0.36) GAAALDH1A1TSHRSMN1; SMN2MAPT
SCHEMBL8106632 0.68 GAA (0.46) GAAALDH1A1SMN1; SMN2CYP1A2MAPT
SCHEMBL8167976 0.67 GAA (0.43) GAAALDH1A1TSHRSMN1; SMN2CYP1A2
SCHEMBL11093182 0.67 CYP1A2 (0.40) GAATSHRCYP1A2MAPTTP53

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
US-7902118-B2 Herbicide and repellent adjuvant; reducing foliage retention; preventing damage to crops BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2011-03-08 US disclosed
US-6936569-B2 Compositions and methods for protecting cultivated plants from herbicidal injury BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2005-08-30 US disclosed
US-20050032645-A1 Compositions and methods for protecting cultivated plants from herbicidal injury BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2005-02-10 US disclosed
US-20020010096-A1 Compositions and methods for protecting cultivated plants from herbicidal injury BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY 2002-01-24 US disclosed
US-6235682-B1 AQUEOUS SOLUTION CONTAINING REPELLENT ADJUVANT BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY 2001-05-22 US disclosed