SCHEMBL8427062

SCHEMBL8427062

COc1nc(C)nc(OC(=O)c2sccc2S(=O)(=O)NC(N)=O)n1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 15/20 0.42
EDNRB P24530 3/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.36

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
SCHEMBL8463167 0.85 EDNRA (0.44) EDNRAEDNRBMEN1KMT2A
SCHEMBL11117907 0.80 EDNRA (0.53) EDNRAMEN1KMT2AMAPT
SCHEMBL2135104 0.79 EDNRA (0.47) EDNRAMEN1KMT2AMAPT
Thifensulfuron-Methyl SCHEMBL20723624 0.77 EDNRA (0.46) EDNRAMEN1KMT2AMAPT
Thifensulfuron-Methyl SCHEMBL9139398 0.77 EDNRA (0.46) EDNRAMEN1KMT2AMAPT
Thifensulfuron-Methyl SCHEMBL29463414 0.77 EDNRA (0.46) EDNRAMEN1KMT2AMAPT
Thifensulfuron-Methyl SCHEMBL53606 0.77 EDNRA (0.46) EDNRAMEN1KMT2AMAPT
Ammonia Solution, Strong SCHEMBL9536160 0.74 EDNRA (0.42) EDNRAMEN1KMT2AMAPT
SCHEMBL10473901 0.74 GAA (0.38) EDNRAEDNRBMAPT
SCHEMBL8973235 0.74 ALDH1A1 (0.41) EDNRAMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5952553-A Herbicide resistant rice BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 1999-09-14 US disclosed
US-5773704-A RESISTANT TO IMAZETHAPYR, IMAZAQUIN, PRIMISULFURON, NICOSULFURON, SULFOMETURON, IMAZAPYR, IMAZAMETH AND IMAZAMOX BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 1998-06-30 US disclosed