Benzene

Benzene

SCHEMBL27615459

NC(=O)C1C=CCCC1C(=O)O.c1ccccc1

nearest known ligand 0.33

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Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
GRM4 Q14833 4/20 0.32
CYP2C19 P33261 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
KMT2A Q03164 1/20 0.32
GRM8 O00222 1/20 0.32
GRM6 O15303 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
GABRR1 P24046 1/20 0.32
SLC1A2 P43004 1/20 0.31
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30

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
SCHEMBL27596921 0.98 MAPT (0.34) MAPTGRM4CYP2C19TDP1MEN1
Benzoyl Chloride SCHEMBL28084223 0.86 PARP1 (0.35) MAPTCYP2C19TDP1MEN1ALDH1A1
SCHEMBL6219581 0.86 MAPT (0.36) MAPTGRM4
Benzene SCHEMBL28106437 0.84 MAPT (0.35) MAPTGRM4CYP2C19TDP1MEN1
SCHEMBL22390581 0.84 MAPT (0.37) MAPTGRM4CYP2C19TDP1MEN1
SCHEMBL5585363 0.84 MAPT (0.37) MAPTGRM4CYP2C19TDP1MEN1
SCHEMBL27341 0.84 MAPT (0.37) MAPTGRM4CYP2C19TDP1MEN1
SCHEMBL248183 0.82 MAPT (0.34) MAPTTDP1POLBAPEX1
Iodide SCHEMBL8077383 0.82 MAPT (0.36) MAPTGRM4CYP2C19TDP1MEN1
Bromide SCHEMBL7615302 0.82 MAPT (0.36) MAPTGRM4CYP2C19TDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101445714-B Polyurethane-imide resin, adhesive composition and adhesive composition for circuit connection HITACHI CHEMICAL CO LTD 2013-03-20 CN disclosed
CN-1637034-B Polyurethane-imide resin, adhesive composition, and adhesive composition for circuit connection HITACHI CHEMICAL CO LTD 2010-04-28 CN disclosed
CN-101445714-A Polyurethane-imide resin, adhesive composition and adhesive composition for circuit connection HITACHI CHEMICAL CO LTD (JP) 2009-06-03 CN disclosed
CN-1637034-A Polyurethane-imide resin, adhesive composition, and adhesive composition for circuit connection HITACHI CHEMICAL CO LTD (JP) 2005-07-13 CN disclosed