SCHEMBL6937807

SCHEMBL6937807

O=C(OC(=O)c1ccc(C(=O)c2ccccc2)cc1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.67
SRD5A2 P31213 3/20 0.62
LMNA P02545 2/20 0.58
F2 P00734 1/20 0.58
ATM Q13315 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
ELANE P08246 4/20 0.55
TSHR P16473 1/20 0.54
RAB9A P51151 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
MAPT P10636 1/20 0.54
MAPK13 O15264 1/20 0.54
MAPK12 P53778 1/20 0.54
MAPK11 Q15759 1/20 0.54
MAPK14 Q16539 1/20 0.54
NPC1 O15118 2/20 0.52
HPGD P15428 2/20 0.52
CES2 O00748 1/20 0.50

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
SCHEMBL6937804 1.00 ALDH1A1 (0.67) ALDH1A1SRD5A2LMNAF2ATM
SCHEMBL8717537 0.93 LMNA (0.67) ALDH1A1SRD5A2LMNAF2TDP1
SCHEMBL19666759 0.92 MAPT (0.62) ALDH1A1SRD5A2LMNAF2ATM
Hydrogen Peroxide SCHEMBL27952375 0.90 LMNA (0.70) ALDH1A1LMNAF2TDP1L3MBTL1
SCHEMBL52413 0.90 LMNA (0.70) ALDH1A1LMNAF2TDP1L3MBTL1
Benzene SCHEMBL27793442 0.90 LMNA (0.70) ALDH1A1LMNAF2TDP1L3MBTL1
SCHEMBL27616691 0.90 L3MBTL1 (0.69) ALDH1A1SRD5A2LMNAF2ATM
SCHEMBL1534569 0.87 LMNA (0.67) ALDH1A1LMNAF2TDP1L3MBTL1
SCHEMBL7050451 0.87 LMNA (0.67) ALDH1A1LMNAF2TDP1L3MBTL1
Phosphine SCHEMBL9591710 0.87 LMNA (0.67) ALDH1A1LMNAF2TDP1L3MBTL1

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 5 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
CN-1262276-A Phosphine sulfide preparing process and use thereof MITSUI CHEMICALS INC (JP) 2000-08-09 CN disclosed
EP-0972776-A1 A phosphine sulfide, a manufacturing process therefor and a use thereof Mitsui Chemicals, Inc. (JP) 2000-01-19 EP disclosed
WO-1999032428-A2 SYNTHESIS OF DIAMINES INTERNATIONAL CENTRE FOR GENETIC ENGINEERING AND BIOTECHNOLOGY (IT) 1999-07-01 WO disclosed