SCHEMBL2425250

SCHEMBL2425250

O=P(Oc1ccccc1)(Oc1ccccc1)OP(=O)(Oc1ccccc1)Oc1ccccc1.Oc1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 1/20 0.50
BCL2L1 Q07817 1/20 0.50
SRC P12931 1/20 0.48
LTA4H P09960 1/20 0.45
NR1H2 P55055 1/20 0.45
BAX Q07812 1/20 0.45
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ESR1 P03372 4/20 0.41
ESR2 Q92731 4/20 0.41
DEGS1 O15121 1/20 0.41

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
Hydroquinone SCHEMBL1900198 0.94 SRC (0.54) MMP3BCL2L1SRCLTA4HNR1H2
SCHEMBL6429904 0.91 MMP3 (0.52) MMP3BCL2L1SRCLTA4HNR1H2
Phenol SCHEMBL17766342 0.90 SRC (0.54) SRCLTA4HNR1H2BAXMEN1
Phenol SCHEMBL28139040 0.90 SRC (0.54) SRCLTA4HNR1H2BAXMEN1
Hydroquinone SCHEMBL7949657 0.85 SRC (0.59) SRCLTA4HNR1H2BAXTDP1
SCHEMBL846983 0.84 LTA4H (0.58) SRCLTA4HNR1H2BAXMEN1
SCHEMBL5667535 0.84 LTA4H (0.58) SRCLTA4HNR1H2BAXMEN1
SCHEMBL1159889 0.84 SRC (0.58) SRCLTA4HMEN1LMNAKMT2A
SCHEMBL14718053 0.84 SRC (0.57) SRCLTA4HNR1H2BAXMEN1
SCHEMBL6429907 0.83 SRC (0.55) MMP3BCL2L1SRCLTA4HNR1H2

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
US-8022122-B2 Derivatives of pyrimidines as flame retardants BASF SE (DE) 2011-09-20 US disclosed
EP-2013279-B1 DERIVATIVES OF PYRIMIDINES AS FLAME RETARDANTS BASF SE (DE) 2010-03-31 EP disclosed
US-20090131565-A1 Derivatives of Pyrimidines as Flame Retardants BASF SE (DE) 2009-05-21 US disclosed
EP-2013279-A1 DERIVATIVES OF PYRIMIDINES AS FLAME RETARDANTS Ciba Holding Inc. (CH) 2009-01-14 EP disclosed
WO-2007128678-A1 DERIVATIVES OF PYRIMIDINES AS FLAME RETARDANTS CIBA HOLDING INC. (CH) 2007-11-15 WO disclosed