SCHEMBL9861683

SCHEMBL9861683

Brc1c(Br)c(OCC2CO2)c(Br)c(Br)c1OCC1CO1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.47
ALDH1A1 P00352 9/20 0.45
TSHR P16473 5/20 0.45
TP53 P04637 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
HIF1A Q16665 2/20 0.45
CYP3A4 P08684 2/20 0.45
GLA P06280 1/20 0.42
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PKM P14618 2/20 0.40
CYP1A2 P05177 1/20 0.40
PPARG P37231 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.35
HBB P68871 1/20 0.30

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
SCHEMBL18297877 0.98 TDP1 (0.45) TDP1ALDH1A1TSHRTP53SMN1; SMN2
SCHEMBL21870056 0.94 TDP1 (0.42) TDP1ALDH1A1TSHRTP53SMN1; SMN2
SCHEMBL9861630 0.81 ALDH1A1 (0.39) TDP1ALDH1A1TSHRTP53SMN1; SMN2
SCHEMBL6358359 0.80 ALDH1A1 (0.43) TDP1ALDH1A1TSHRTP53SMN1; SMN2
SCHEMBL5704079 0.77 ALDH1A1 (0.47) TDP1ALDH1A1TSHRTP53SMN1; SMN2
SCHEMBL29719280 0.77 ALDH1A1 (0.47) TDP1ALDH1A1TSHRTP53SMN1; SMN2
SCHEMBL29719415 0.77 ALDH1A1 (0.47) TDP1ALDH1A1TSHRTP53SMN1; SMN2
SCHEMBL16716243 0.76 TDP1 (0.47) TDP1ALDH1A1TSHRTP53SMN1; SMN2
SCHEMBL19342768 0.76 ALDH1A1 (0.52) TDP1ALDH1A1TSHRTP53SMN1; SMN2
SCHEMBL28979897 0.76 ALDH1A1 (0.47) TDP1ALDH1A1TSHRTP53SMN1; SMN2

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
US-5034440-A Halogenated polyesters modified with glycidyl groups for fireproof electrical wire covers POLYPLASTICS CO., LTD. (JP) 1991-07-23 US disclosed