SCHEMBL9705543

SCHEMBL9705543

Cn1nc(-c2ccccc2Cl)nc1-c1ccccc1C(F)(F)F

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 19/20 0.62
TRPA1 O75762 1/20 0.41

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
SCHEMBL4611901 0.95 HSD11B1 (0.56) HSD11B1TRPA1
SCHEMBL9830823 0.94 HSD11B1 (0.62) HSD11B1TRPA1
SCHEMBL9830651 0.91 HSD11B1 (0.54) HSD11B1
SCHEMBL9830541 0.90 HSD11B1 (0.58) HSD11B1TRPA1
SCHEMBL9829989 0.90 HSD11B1 (0.53) HSD11B1TRPA1
SCHEMBL9832170 0.89 HSD11B1 (0.54) HSD11B1TRPA1
SCHEMBL9831595 0.89 HSD11B1 (0.56) HSD11B1TRPA1
SCHEMBL9831676 0.89 HSD11B1 (0.53) HSD11B1TRPA1
SCHEMBL9829841 0.89 HSD11B1 (0.66) HSD11B1
SCHEMBL6781711 0.87 HSD11B1 (0.48) HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0185256-B1 TRIAZOLE DERIVATES, THEIR PREPARATION AND THEIR USE AS PESTICIDES CIBA-GEIGY AG (CH) 1991-01-30 EP claimed
US-4788210-A PESTICIDES HOFFMANN-LA ROCHE INC. (US) 1988-11-29 US claimed
EP-0185256-A2 Triazole derivates, their preparation and their use as pesticides CIBA-GEIGY AG (CH) 1986-06-25 EP claimed
EP-0192034-B1 DIBENZAZEPINE DERIVATIVES, THEIR PREPARATION, STARTING MATERIALS FOR THEIR PREPARATION, AND USE OF THE DIBENZAZEPINE DERIVATIVES AS PESTICIDES CIBA-GEIGY AG (CH) 1992-07-15 EP disclosed
EP-0185256-B1 TRIAZOLE DERIVATES, THEIR PREPARATION AND THEIR USE AS PESTICIDES CIBA-GEIGY AG (CH) 1991-01-30 EP disclosed
US-4833245-A CHEMICAL INTERMEDIATES FOR INSECTICIDES HOFFMANN-LA ROCHE INC. (US) 1989-05-23 US disclosed
US-4788210-A PESTICIDES HOFFMANN-LA ROCHE INC. (US) 1988-11-29 US disclosed
US-4766115-A 5,6-dihydro-6H-dibenz[c,e]azepine-6-(thio)carboximidic acid esters and insecticidal use thereof HOFFMANN-LA ROCHE INC. (US) 1988-08-23 US disclosed
EP-0192034-A2 Dibenzazepine derivatives, their preparation, starting materials for their preparation, and use of the dibenzazepine derivatives as pesticides CIBA-GEIGY AG (CH) 1986-08-27 EP disclosed
EP-0185256-A2 Triazole derivates, their preparation and their use as pesticides CIBA-GEIGY AG (CH) 1986-06-25 EP disclosed