SCHEMBL28694359

SCHEMBL28694359

Brc1ccccc1[PH](Br)(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL304911 0.76 ALDH1A1 (0.39) ALDH1A1MAPK1TDP1
SCHEMBL7652818 0.74 ALDH1A1 (0.38) ALDH1A1MAPK1TDP1
SCHEMBL14603871 0.74 ALDH1A1 (0.34) ALDH1A1MAPK1TDP1
SCHEMBL28993879 0.73 ALDH1A1 (0.37) ALDH1A1MAPK1TDP1
SCHEMBL10277371 0.73 ALDH1A1 (0.37) ALDH1A1MAPK1TDP1
Bromide SCHEMBL9723310 0.73 ALDH1A1 (0.37) ALDH1A1MAPK1TDP1
SCHEMBL28738751 0.73 ALDH1A1 (0.37) ALDH1A1MAPK1TDP1
SCHEMBL15466997 0.73 ALDH1A1 (0.37) ALDH1A1MAPK1TDP1
SCHEMBL11771096 0.64 ALDH1A1 (0.39) ALDH1A1MAPK1TDP1
SCHEMBL9723314 0.64 ALDH1A1 (0.39) ALDH1A1MAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114163638-A Polyimide precursor resin, resin composition, and diamine compound 北京鼎材科技有限公司 2022-03-11 CN disclosed