SCHEMBL9780403

SCHEMBL9780403

Brc1ccccc1Oc1c(Br)c(Br)c(Br)c(Oc2c(Br)c(Br)c(Br)c(Br)c2Br)c1Br

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.42
ALOX12 P18054 3/20 0.42
MAPT P10636 3/20 0.39
HPGD P15428 3/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
TP53 P04637 1/20 0.39
GLA P06280 1/20 0.39
HSD17B10 Q99714 1/20 0.39
AKR1B1 P15121 2/20 0.37
HTR7 P34969 1/20 0.36
TTR P02766 1/20 0.36
RAB9A P51151 2/20 0.35
GRM4 Q14833 1/20 0.35
LMNA P02545 2/20 0.35
GAA P10253 1/20 0.34
LCK P06239 1/20 0.34
DHODH Q02127 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
USP2 O75604 2/20 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
SCHEMBL9780470 0.98 ALOX15 (0.43) ALOX15ALOX12MAPTHPGDALDH1A1
SCHEMBL9155074 0.96 ALOX15 (0.42) ALOX15ALOX12MAPTHPGDALDH1A1
SCHEMBL192255 0.96 ALOX15 (0.44) ALOX15ALOX12MAPTHPGDALDH1A1
SCHEMBL6740248 0.80 ALOX15 (0.38) ALOX15ALOX12MAPTHPGDALDH1A1
SCHEMBL752948 0.80 ALOX15 (0.39) ALOX15ALOX12MAPTHPGDALDH1A1
SCHEMBL30076240 0.80 ALOX15 (0.39) ALOX15ALOX12MAPTHPGDALDH1A1
SCHEMBL727333 0.78 ALDH1A1 (0.48) ALDH1A1HTR7TTRRAB9AGRM4
SCHEMBL11210044 0.76 ALOX15 (0.34) ALOX15ALOX12MAPTHPGDALDH1A1
SCHEMBL9064777 0.76 GRM4 (0.38) ALOX15ALOX12MAPTHPGDALDH1A1
SCHEMBL3842507 0.76 MAPK1 (0.46) ALDH1A1HTR7TTRRAB9AGRM4

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
US-4981890-A POLYHALOAROMATIC AND AROMATIC BIS-SULFONAMIDE ETHYL CORPORATION (US) 1991-01-01 US disclosed
US-4957957-A Polymer compositions containing aromatic sulfonamide ETHYL CORPORATION (US) 1990-09-18 US disclosed