SCHEMBL8306962

SCHEMBL8306962

CS(=O)(=O)NC(=O)c1cccc(Oc2ccc(C(F)(F)F)cc2Cl)c1[N+](=O)[O-]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 4/20 0.53
MAPT P10636 3/20 0.50
LMNA P02545 2/20 0.50
POLB P06746 1/20 0.50
CCR6 P51684 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
GPR55 Q9Y2T6 1/20 0.50
TDP1 Q9NUW8 2/20 0.48
MEN1 O00255 1/20 0.48
TTR P02766 1/20 0.48
PPOX P50336 1/20 0.48
KMT2A Q03164 1/20 0.48
FLT1 P17948 1/20 0.44
FLT4 P35916 1/20 0.44
KDR P35968 1/20 0.44
SCN9A Q15858 3/20 0.42
CCR1 P32246 1/20 0.42
CCR2 P41597 1/20 0.42
SCN8A Q9UQD0 3/20 0.42
SCN10A Q9Y5Y9 3/20 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
SCHEMBL30539397 0.85 TDP1 (0.64) MRGPRX4MAPTLMNAPOLBCCR6
SCHEMBL9863812 0.85 TDP1 (0.64) MRGPRX4MAPTLMNAPOLBCCR6
SCHEMBL8304645 0.85 TDP1 (0.64) MRGPRX4MAPTLMNAPOLBCCR6
SCHEMBL27592434 0.84 TDP1 (0.63) MRGPRX4MAPTLMNAPOLBCCR6
SCHEMBL11365185 0.84 TDP1 (0.54) MRGPRX4MAPTLMNAPOLBCCR6
SCHEMBL10910166 0.83 MAPT (0.49) MRGPRX4MAPTLMNAPOLBCCR6
SCHEMBL11029175 0.83 TDP1 (0.53) MRGPRX4MAPTLMNAPOLBCCR6
Fomesafen SCHEMBL16881788 0.81 TDP1 (0.71) MRGPRX4MAPTLMNAPOLBCCR6
Fomesafen SCHEMBL39607 0.81 TDP1 (0.71) MRGPRX4MAPTLMNAPOLBCCR6
Fomesafen SCHEMBL29366195 0.81 TDP1 (0.71) MRGPRX4MAPTLMNAPOLBCCR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5883044-A Herbicidal method utilizing phosphosulfonate herbicides and oxime ether safeners ROHM AND HAAS COMPANY (US) 1999-03-16 US disclosed
US-H1785-H PRE- AND POST-EMERGENCE HERBICIDE FMC CORPORATION (US) 1999-02-02 US disclosed
US-5861359-A WHEAT, SOYBEANS, CORN; PRE- AND POSTEMERGENCE HERBICIDES FMC CORPORATION (US) 1999-01-19 US disclosed
US-H1759-H NEW HERBICIDE MOLECULAR COMPRISING A RING SELECT FROM THE GROUP OF PYRIMIDINE, TRIAZOLE, PYRAZOLE, ISOINDOLE, THIADIAZOLO(3,4-A)PYRIDAZINE, TRIAZINE(1,2,4), INDAZOLE, TETRAZOLE, TRIAZOLE(4,3-A)PYRIDINE FMC CORPORATION (US) 1998-11-03 US disclosed
US-5753595-A Herbicidal 3-(substituted benzoxazol-7-yl) and 3-(Substituted benzothiazol-7-yl)-1-substituted-6-trifluoromethyl-2 4-(1h 3h)pyrimidinediones FMC CORPORATION (US) 1998-05-19 US disclosed
US-5693590-A PLANT GROWTH REGULATOR ROHM AND HAAS COMPANY (US) 1997-12-02 US disclosed
US-5683966-A Herbicidal 3-(substituted-benzyl)-1-methyl-6-trifluoromethyluracils FMC CORPORATION (US) 1997-11-04 US disclosed
US-5674810-A MIXTURE OF TWO HERBICIDES WITH DIFFERENT STRUCTURES, CARRIER FMC CORPORATION (US) 1997-10-07 US disclosed
US-5502027-A ALGICIDES ROHM AND HAAS COMPANY (US) 1996-03-26 US disclosed
US-5076830-A INDAN-1,3-DIONE DERIVATIVE AND HERBICIDAL COMPOSITION CONTAINING THE SAME AS ACTIVE INGREDIENT MITSUBISHI KASEI CORPORATION (JP) 1991-12-31 US disclosed
US-4754052-A REDUCTION, DEAMINATION ICI AMERICAS INC. (US) 1988-06-28 US disclosed