SCHEMBL9814306

SCHEMBL9814306

C=CC(C)(C)Br.CC(C)=CCBr

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.43
HIF1A Q16665 3/20 0.34
EPAS1 Q99814 3/20 0.34
TSHR P16473 2/20 0.32

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
SCHEMBL39385 0.79
SCHEMBL15318919 0.76
Hydrochloric Acid SCHEMBL18338548 0.73
SCHEMBL28640798 0.73 ALDH1A1 (0.40) ALOX15
SCHEMBL2192 0.72
Chlorolithium SCHEMBL23457018 0.71
Hydrogen Sulfide SCHEMBL2510222 0.69
SCHEMBL809010 0.69
SCHEMBL28466167 0.68 ALOX15 (0.61) ALOX15HIF1AEPAS1TSHR
SCHEMBL3726662 0.67 ALOX15 (0.43) ALOX15HIF1AEPAS1TSHR

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
EP-0262428-B1 HYDANTOIN DERIVATIVES AND HERBICIDES CONTAINING THE DERIVATIVES AS AN ACTIVE INGREDIENT SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-08-14 EP disclosed
EP-0262428-A1 Hydantoin derivatives and herbicides containing the derivatives as an active ingredient SAGAMI CHEMICAL RESEARCH CENTER (JP) 1988-04-06 EP disclosed