SCHEMBL8402932

SCHEMBL8402932

CCC(O)(O)c1c[nH]c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 4/20 0.50
FFAR1 O14842 1/20 0.47
ATM Q13315 1/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPT P10636 2/20 0.44
CYP3A4 P08684 2/20 0.44
AHR P35869 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 2/20 0.44
HPGD P15428 1/20 0.44
PBRM1 Q86U86 1/20 0.43
CYP2D6 P10635 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
PKM P14618 1/20 0.42
HTR2A P28223 2/20 0.41
HTR1A P08908 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
SCHEMBL7029009 0.81 GPR84 (0.49) GPR84FFAR1ATMMEN1KMT2A
SCHEMBL19059561 0.80 GPR84 (0.47) GPR84FFAR1ATMMEN1KMT2A
SCHEMBL13611510 0.80 GPR84 (0.47) GPR84FFAR1ATMMEN1KMT2A
SCHEMBL2186761 0.79 PBRM1 (0.45) GPR84MEN1KMT2AMAPTKDM4E
SCHEMBL25439220 0.76 MEN1 (0.46) GPR84FFAR1ATMMEN1KMT2A
SCHEMBL27719429 0.76 ATM (0.43) GPR84ATMMEN1KMT2AMAPT
SCHEMBL27756724 0.76 ALDH1A1 (0.49) GPR84ATMMEN1KMT2AMAPT
SCHEMBL27939140 0.76 PBRM1 (0.45) GPR84MEN1KMT2AMAPTKDM4E
SCHEMBL13335152 0.75 ATM (0.54) GPR84FFAR1ATMMEN1KMT2A
SCHEMBL29885789 0.75 ATM (0.54) GPR84FFAR1ATMMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6008398-A Non-nucleotide phosphorus ester oligomers GENZYME CORPORATION (US) 1999-12-28 US disclosed
US-5919965-A Non-nucleotide phosphorus ester oligomers GENZYME CORPORATION (US) 1999-07-06 US disclosed
EP-0880532-A4 NON-NUCLEOTIDE PHOSPHOROUS ESTER OLIGOMERS PHARMAGENICS INC (US) 1999-06-09 EP disclosed
EP-0880532-A1 NON-NUCLEOTIDE PHOSPHOROUS ESTER OLIGOMERS PHARMAGENICS, INC. (US) 1998-12-02 EP disclosed
EP-0804443-A4 NON-NUCLEOTIDE PHOSPHORUS ESTER OLIGOMERS PHARMAGENICS INC (US) 1998-04-29 EP disclosed
EP-0804443-A1 NON-NUCLEOTIDE PHOSPHORUS ESTER OLIGOMERS PHARMAGENICS, INC. (US) 1997-11-05 EP disclosed
WO-1997028168-A1 NON-NUCLEOTIDE PHOSPHOROUS ESTER OLIGOMERS PHARMAGENICS, INC. (US) 1997-08-07 WO disclosed
WO-1996022297-A9 NON-NUCLEOTIDE PHOSPHORUS ESTER OLIGOMERS 1996-10-03 WO disclosed
WO-1996022297-A1 NON-NUCLEOTIDE PHOSPHORUS ESTER OLIGOMERS PHARMAGENICS, INC. (US) 1996-07-25 WO disclosed