SCHEMBL6939130

SCHEMBL6939130

O=C(Oc1c(Br)cc(-c2cc(Br)c(OC(=O)c3ccccc3)c(Br)c2)cc1Br)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.47
▸ KMT2A Q03164 5/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ LMNA P02545 3/20 0.47
▸ HTT P42858 2/20 0.47
▸ CRHBP P24387 2/20 0.47
▸ CRHR2 Q13324 2/20 0.47
▸ F2 P00734 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.44
▸ GAA P10253 2/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ SENP1 Q9P0U3 1/20 0.43
▸ PARP10 Q53GL7 1/20 0.43

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
SCHEMBL283401 0.87 ESR1 (0.49) MAPTKMT2AMEN1TDP1LMNA
SCHEMBL18263212 0.85 LMNA (0.50) MAPTKMT2AMEN1TDP1LMNA
SCHEMBL26212133 0.83 HPGD (0.44) MAPTKMT2AMEN1TDP1LMNA
SCHEMBL6939817 0.82 MAPT (0.50) MAPTKMT2AMEN1TDP1LMNA
SCHEMBL5551848 0.80 LMNA (0.64) MAPTKMT2AMEN1TDP1LMNA
SCHEMBL27538003 0.79 THRB (0.46) MAPTKMT2ALMNAHTTCRHBP
SCHEMBL2772583 0.79 LMNA (0.52) MAPTKMT2AMEN1TDP1LMNA
SCHEMBL9173276 0.78 HTT (0.47) MAPTKMT2AMEN1LMNAHTT
SCHEMBL14580064 0.77 TDP1 (0.46) MAPTKMT2AMEN1TDP1LMNA
SCHEMBL18946357 0.77 MAPT (0.46) MAPTKMT2AMEN1TDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0972776-B1 A phosphine sulfide, a manufacturing process therefor and a use thereof MITSUI CHEMICALS INC (JP) 2003-04-23 — — EP disclosed
US-6153794-A Phosphine sulfide, a manufacturing process therefor and use thereof MITSUI CHEMICALS, INC. (JP) 2000-11-28 — — US disclosed
EP-0972776-A1 A phosphine sulfide, a manufacturing process therefor and a use thereof Mitsui Chemicals, Inc. (JP) 2000-01-19 — — EP disclosed
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