Furfural

Furfural

SCHEMBL7995124

C=CC.O=C(O)O.O=Cc1ccco1

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Furfural. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.67
HCAR2 Q8TDS4 1/20 0.50
MASP2 O00187 1/20 0.46
F2 P00734 1/20 0.46
KMT2A Q03164 6/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
MAPT P10636 6/20 0.44
POLB P06746 4/20 0.44
TDP1 Q9NUW8 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 5/20 0.43
RECQL P46063 1/20 0.43
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
PLA2G7 Q13093 1/20 0.41
GAA P10253 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40

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
Furfural SCHEMBL15547486 0.92 ALDH1A1 (0.78) ALDH1A1HCAR2MASP2F2KMT2A
Furfural SCHEMBL17671277 0.90 ALDH1A1 (0.82) ALDH1A1HCAR2MASP2F2KMT2A
Furfural SCHEMBL28255155 0.88 ALDH1A1 (0.78) ALDH1A1HCAR2MASP2F2KMT2A
Furfural SCHEMBL11426335 0.87 ALDH1A1 (0.69) ALDH1A1HCAR2MASP2F2KMT2A
Furfural SCHEMBL2441944 0.86 ALDH1A1 (0.75) ALDH1A1HCAR2MASP2F2KMT2A
Furfural SCHEMBL19951030 0.86 ALDH1A1 (0.75) ALDH1A1HCAR2MASP2F2KMT2A
Furfural SCHEMBL27188973 0.85 ALDH1A1 (0.72) ALDH1A1HCAR2MASP2F2KMT2A
Furfural SCHEMBL6343654 0.84 ALDH1A1 (0.78) ALDH1A1HCAR2MASP2F2KMT2A
Furfural SCHEMBL653628 0.84 ALDH1A1 (0.78) ALDH1A1HCAR2MASP2F2KMT2A
Furfural SCHEMBL27941744 0.84 ALDH1A1 (0.78) ALDH1A1HCAR2MASP2F2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104662074-A Recycling carbon fibers from epoxy resins using solvent cracking EMPIRE TECHNOLOGY DEV LLC 2015-05-27 CN disclosed
US-8920932-B2 Recycling carbon fibers from epoxy using solvent cracking EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2014-12-30 US disclosed
CN-102952570-B Method for preparing environment-friendly rubber oil by two-stage countercurrent solvent extraction PETROCHINA CO LTD 2014-12-24 CN disclosed
CN-102952569-B Method for preparing environment-friendly rubber oil by extraction of ternary composite solvent PETROCHINA CO LTD 2014-12-24 CN disclosed
CN-102952569-A Method for preparing environment-friendly rubber oil by extraction of ternary composite solvent PETROCHINA CO LTD 2013-03-06 CN disclosed
CN-102952570-A Method for preparing environment-friendly rubber oil by two-stage countercurrent solvent extraction PETROCHINA CO LTD 2013-03-06 CN disclosed
US-6146520-A SOLVENT EXTRACTION OF VACUUM DISTILLATES WITH DIMETHYL SULFOXIDE, SULFOLANE, OR PROPYLENE CARBONATE; REMOVAL OF POLYCYCLIC AROMATICS MOBIL OIL CORPORATION (US) 2000-11-14 US disclosed
EP-0980415-A4 SELECTIVE RE-EXTRACTION OF LUBE EXTRACTS TO REDUCE MUTAGENICITY INDEX MOBIL OIL CORP (US) 2000-06-14 EP disclosed
EP-0980415-A1 SELECTIVE RE-EXTRACTION OF LUBE EXTRACTS TO REDUCE MUTAGENICITY INDEX ExxonMobil Oil Corporation (US) 2000-02-23 EP disclosed
WO-1998044075-A1 SELECTIVE RE-EXTRACTION OF LUBE EXTRACTS TO REDUCE MUTAGENICITY INDEX MOBIL OIL CORPORATION (US) 1998-10-08 WO disclosed