SCHEMBL10620495

SCHEMBL10620495

O=CC(Br)=Cc1ccccc1C=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
THRB P10828 1/20 0.56
BLM P54132 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
TRIM24 O15164 2/20 0.46
TRIM33 Q9UPN9 2/20 0.46
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.41
ERN1 O75460 4/20 0.39
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SRC P12931 1/20 0.37
GAA P10253 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
TLR2 O60603 1/20 0.33
TLR1 Q15399 1/20 0.33
TLR6 Q9Y2C9 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
SCHEMBL38655968 0.79 TRPA1 (0.48) LMNAKMT2AMEN1ALDH1A1HPGD
SCHEMBL8746741 0.76 LMNA (0.59) LMNAKMT2AMEN1THRBBLM
Ortho-Phthalaldehyde SCHEMBL4953869 0.75 LMNA (1.00) LMNAKMT2AMEN1THRBBLM
Ortho-Phthalaldehyde SCHEMBL29412642 0.75 LMNA (1.00) LMNAKMT2AMEN1THRBBLM
Ortho-Phthalaldehyde SCHEMBL33393 0.75 LMNA (1.00) LMNAKMT2AMEN1THRBBLM
SCHEMBL9682291 0.75 LMNA (0.52) LMNAKMT2AMEN1THRBBLM
SCHEMBL9682285 0.75 LMNA (0.52) LMNAKMT2AMEN1THRBBLM
SCHEMBL38654587 0.75 NFE2L2 (0.50) LMNAKMT2AMEN1TDP1ERN1
SCHEMBL5030176 0.74 ALDH1A1 (0.57) LMNAKMT2AMEN1THRBBLM
Ortho-Phthalaldehyde SCHEMBL9628156 0.73 LMNA (0.81) LMNAKMT2AMEN1THRBBLM

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-4749392-A Dehumidifying material KAKEN PHARMACEUTICAL CO., LTD. (JP) 1988-06-07 US disclosed
EP-0225593-A2 Dehumidifying material Kaken Pharmaceutical Co., Ltd. (JP) 1987-06-16 EP disclosed