SCHEMBL6334648

SCHEMBL6334648

Cc1ccc(C(c2ccc(O)c(Br)c2)(c2ccc(O)c(Br)c2)c2ccc(O)c(Br)c2)c(-c2ccc(O)c(Br)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 6/20 0.42
ALOX12 P18054 2/20 0.42
IDO1 P14902 2/20 0.37
RAB9A P51151 3/20 0.34
NPC1 O15118 2/20 0.34
CSNK2A1 P68400 2/20 0.34
HSP90AA1 P07900 1/20 0.34
CSNK2A2 P19784 1/20 0.34
CSNK2B P67870 1/20 0.34
TRPA1 O75762 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
TP53 P04637 2/20 0.33
ESR1 P03372 2/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
ESR2 Q92731 1/20 0.33
MCL1 Q07820 1/20 0.33
HSD17B10 Q99714 3/20 0.32
MEN1 O00255 3/20 0.32
LMNA P02545 3/20 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
SCHEMBL5953384 0.84 TP53 (0.48) IDO1TRPA1TDP1TP53ESR1
SCHEMBL6341892 0.81 TSHR (0.42) ALOX15ALOX12RAB9ANPC1CSNK2A1
SCHEMBL6342106 0.80 RARB (0.42) ALOX15IDO1TRPA1TDP1TP53
SCHEMBL6333440 0.80 ESR2 (0.39) IDO1HSP90AA1TRPA1TDP1TP53
SCHEMBL6336529 0.80 KDM4E (0.39) ALOX15IDO1RAB9ANPC1HSP90AA1
SCHEMBL6333099 0.78 CNR2 (0.43) ALOX15IDO1RAB9ANPC1HSP90AA1
SCHEMBL6343778 0.77 ALOX15 (0.35) ALOX15ALOX12RAB9ANPC1HSP90AA1
SCHEMBL27685537 0.77 TDP1 (0.45) ALOX15ALOX12IDO1RAB9ANPC1
SCHEMBL2954728 0.75 MAOB (0.41) RAB9ANPC1CSNK2A1CSNK2A2CSNK2B
SCHEMBL6341910 0.74 AKR1C2 (0.36) ALOX15ALOX12TDP1HSD17B10MEN1

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-20050228167-A1 Molecular compounds containing polymers having hydrogen bond sites as the constituent compounds NIPPON SODA CO., LTD. (JP) 2005-10-13 US disclosed