SCHEMBL7849778

SCHEMBL7849778

COc1ccc(Cl)n2nc(S(=O)(=O)Nc3c(F)cccc3F)nc12

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
PDE10A Q9Y233 2/20 0.37
TSHR P16473 1/20 0.37
CCR4 P51679 2/20 0.36
SLC40A1 Q9NP59 1/20 0.35
POLB P06746 1/20 0.35
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
THRB P10828 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL7853022 0.87 GAA (0.47) GAASMN1; SMN2KMT2AMAPK1ALDH1A1
SCHEMBL7854314 0.81 SLC40A1 (0.36) SMN1; SMN2KMT2AALDH1A1TSHRCCR4
SCHEMBL7842349 0.80 GAA (0.39) GAASMN1; SMN2KMT2AMAPK1TSHR
SCHEMBL7851696 0.79 GAA (0.45) GAASMN1; SMN2KMT2AMAPK1ALDH1A1
SCHEMBL8848553 0.78 CCR4 (0.39) GAASMN1; SMN2KMT2AMAPK1TSHR
SCHEMBL7841153 0.78 TRPV4 (0.36) MAPK1ALDH1A1MAPTPDE10ALMNA
Florasulam SCHEMBL116614 0.76 GAA (0.39) GAASMN1; SMN2KMT2AMAPK1TSHR
Florasulam SCHEMBL18955499 0.76 GAA (0.39) GAASMN1; SMN2KMT2AMAPK1TSHR
SCHEMBL8825630 0.74 CCR4 (0.44) GAASMN1; SMN2KMT2AMAPK1CCR4
SCHEMBL910274 0.74 GAA (0.42) GAASMN1; SMN2KMT2AMAPK1TSHR

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
EP-0717743-B1 N-ARYL 1,2,4]TRIAZOLO 1,5-a]PYRIDINE-2-SULFONAMIDE HERBICIDES DOW AGROSCIENCES LLC (US) 2001-11-14 EP disclosed
EP-1071683-A1 NEW COMPOUNDS AstraZeneca AB (SE) 2001-01-31 EP disclosed
EP-0972774-A2 2-Benzylthio-8-amino(1,2,4)triazolo(1,5-pyridines Dow AgroSciences LLC (US) 2000-01-19 EP disclosed
WO-1999046264-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 1999-09-16 WO disclosed
US-5571775-A EFFECTIVE ON A BROAD SPECTRUM OF VEGETATION AT LOW APPLICATION RATES DOWELANCO (US) 1996-11-05 US disclosed
WO-1996001826-A1 N-ARYL[1,2,4]TRIAZOLO[1,5-a]PYRIDINE-2-SULFONAMIDE HERBICIDES DOWELANCO (US) 1996-01-25 WO disclosed