SCHEMBL11079871

SCHEMBL11079871

O=C=Nc1ccc(SC(F)(F)Cl)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
CYP3A4 P08684 2/20 0.38
TRPA1 O75762 1/20 0.38
TSHR P16473 1/20 0.34
CYP1A2 P05177 1/20 0.33
HTR3E A5X5Y0 1/20 0.31
HTR3B O95264 1/20 0.31
HTR3A P46098 1/20 0.31
HTR3D Q70Z44 1/20 0.31
HTR3C Q8WXA8 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
SCHEMBL11534389 0.92 MAPK1 (0.54) MAPK1TDP1CYP3A4TRPA1TSHR
SCHEMBL2789021 0.90 MAPK1 (0.56) MAPK1TDP1CYP3A4TRPA1TSHR
SCHEMBL11091500 0.89 MAPK1 (0.58) MAPK1TDP1CYP3A4TRPA1TSHR
SCHEMBL11736495 0.87 MAPK1 (0.56) MAPK1TDP1CYP3A4TRPA1TSHR
SCHEMBL11529366 0.85 MAPK1 (0.50) MAPK1TDP1CYP3A4TRPA1TSHR
SCHEMBL11528878 0.83 MAPK1 (0.42) MAPK1TDP1CYP3A4TRPA1TSHR
SCHEMBL10930709 0.80 MAPK1 (0.51) MAPK1TDP1CYP3A4TRPA1TSHR
SCHEMBL9858894 0.78 MAPK1 (0.61) MAPK1TDP1CYP3A4TRPA1TSHR
SCHEMBL11016129 0.78 MAPK1 (0.49) MAPK1TDP1CYP3A4TRPA1TSHR
SCHEMBL11529569 0.77 MAPK1 (0.56) MAPK1TDP1CYP3A4TRPA1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4465682-A Combating pests with substituted 3,6-diphenyl-3,4-dihydro-2H-1,3,5-oxadiazine-2,4-diones BAYER AKTIENGESELLSCHAFT (DE) 1984-08-14 US disclosed
EP-0010250-B1 USE OF SULFONANILIDES IN INHIBITION OF PLANT GROWTH BAYER AG (DE) 1984-02-08 EP disclosed
US-4348394-A Combating pests with substituted 3,6-diphenyl-3,4-dihydro-2H-1,3,5-oxadiazine-2,4-diones BAYER AKTIENGESELLSCHAFT (DE) 1982-09-07 US disclosed
EP-0014881-B1 OXADIAZINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PESTICIDES BAYER AG (DE) 1982-02-17 EP disclosed
EP-0007541-B1 SUBSTITUTED 5-PHENYLCARBAMOYL-BARBITURIC ACIDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS INSECTICIDES BAYER AG (DE) 1981-09-09 EP disclosed
US-4239762-A INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1980-12-16 US disclosed
EP-0014881-A1 Oxadiazine derivatives, process for their preparation and their use as pesticides BAYER AG (DE) 1980-09-03 EP disclosed
EP-0011182-A2 Substituted phenyliminomethyl ureas, process for their preparation and their use as plant bactericides BAYER AG (DE) 1980-05-28 EP disclosed
EP-0010249-A2 Herbicidal agents, process for their preparation and their use in combating weeds BAYER AG (DE) 1980-04-30 EP disclosed
EP-0010250-A2 Use of Sulfonanilides in inhibition of plant growth BAYER AG (DE) 1980-04-30 EP disclosed
EP-0007541-A1 Substituted 5-phenylcarbamoyl-barbituric acids, process for their preparation and their use as insecticides BAYER AG (DE) 1980-02-06 EP disclosed
US-4140792-A INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1979-02-20 US disclosed
US-4075235-A N-Aryl-urea compounds and herbicidal compositions BAYER AKTIENGESELLSCHAFT (DT) 1978-02-21 US disclosed
US-4039315-A N-(Difluorochloromethylmercaptophenyl)ureas as herbicides BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 US disclosed
US-3931312-A Novel N(-difluoromethylmercaptophenyl) urea compounds and herbicidal compositions BAYER AKTIENGESELLSCHAFT (DT) 1976-01-06 US disclosed