Benzene

Benzene

SCHEMBL4958274

CC(C)c1ccc2c(c1)C(=O)OC2=O.c1ccccc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
ALOX15 P16050 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.40
HDAC4 P56524 2/20 0.40
HDAC8 Q9BY41 2/20 0.40
CA1 P00915 2/20 0.40
RNASEH1 O60930 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MDM4 O15151 1/20 0.40
CA2 P00918 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
TYR P14679 1/20 0.40
ALOX12 P18054 1/20 0.40
CA5A P35218 1/20 0.40
HTT P42858 1/20 0.40
MDM2 Q00987 1/20 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
SCHEMBL11436231 0.98 LMNA (0.52) LMNAALOX15TDP1ALDH1A1HPGD
SCHEMBL433935 0.86 ALDH1A1 (0.48) LMNAALOX15TDP1ALDH1A1CA1
SCHEMBL18024822 0.83 LMNA (0.46) LMNAALOX15TDP1ALDH1A1HPGD
SCHEMBL15511869 0.83 TDP1 (0.45) LMNAALOX15TDP1ALDH1A1HPGD
SCHEMBL10328403 0.82 UGT2B7 (0.46) LMNAALOX15TDP1ALDH1A1CA1
SCHEMBL9718941 0.82 ALOX15 (0.43) LMNAALOX15TDP1ALDH1A1CA1
SCHEMBL13397789 0.79 HDAC4 (0.47) LMNAALOX15TDP1ALDH1A1HPGD
SCHEMBL2820073 0.78 FFAR1 (0.49) ALDH1A1CA1CSNK2A2CSNK2BCSNK2A1
SCHEMBL4958265 0.78 TDP1 (0.41) LMNAALOX15TDP1ALDH1A1MAPT
SCHEMBL22017376 0.78 ALOX15 (0.46) ALOX15TDP1ALDH1A1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1321487-B1 POLYAMIC ACID, POLYIMIDE, PROCESS FOR PRODUCING THESE, AND FILM OF THE POLYIMIDE MITSUI CHEMICALS INC (JP) 2008-02-27 EP disclosed
EP-1148078-B1 POLYIMIDE CONTAINING CROSSLINKABLE GROUP AND PROCESS FOR PRODUCING THE SAME MITSUI CHEMICALS INC (JP) 2006-11-29 EP disclosed
US-6734276-B2 RANDOM COPOLYMER WITH UNITS DERIVED FROM PYROMELLITIC ACID, P-PHENYLENEDIAMINE, AND AT LEAST ONE OF M-PHENYLENEDIAMINE, BIS(P-AMINOPHENYL) ETHER, AND DIAMINOMETHYLNORBORNANE; LINEAR EXPANSION COEFFICIENT; SHRINKAGE INHIBITION MITSUI CHEMICALS, INC. (JP) 2004-05-11 US disclosed
US-6710160-B2 VARNISH HAVING IMPROVED SMOOTHNESS, THERMAL RESISTANCE, MELT FLOWABILITY, OPTICAL PROPERTIES AND CHEMICAL RESISTANCE; DIELECTRICS MITSUI CHEMICALS, INC. (JP) 2004-03-23 US disclosed
EP-1321487-A1 POLYAMIC ACID, POLYIMIDE, PROCESS FOR PRODUCING THESE, AND FILM OF THE POLYIMIDE Mitsui Chemicals, Inc. (JP) 2003-06-25 EP disclosed
US-20030064235-A1 Optical members made of polymide resins MITSUI CHEMICALS, INC. (JP) 2003-04-03 US disclosed
US-6531568-B1 Melt processable thermoplastic resins formed from chemical intermediates such as polyamic acids having chemical, heat, oxidation and radiation resistance MITSUI CHEMICALS, INC. (JP) 2003-03-11 US disclosed
US-20030013838-A1 Novel polyimide and circuit substrate comprising the same MITSUI CHEMICALS, INC. (JP) 2003-01-16 US disclosed
US-20020188090-A1 Polyamic acid, polyimide, process for producing these, and film of the polyimide MITSUI CHEMICALS, INC. (JP) 2002-12-12 US disclosed
EP-1236756-A1 NOVEL POLYIMIDE AND CIRCUIT SUBSTRATE COMPRISING THE SAME Mitsui Chemicals, Inc. (JP) 2002-09-04 EP disclosed
EP-1237015-A1 OPTICAL MEMBERS MADE OF POLYIMIDE RESINS Mitsui Chemicals, Inc. (JP) 2002-09-04 EP disclosed
EP-1148078-A1 POLYIMIDE CONTAINING CROSSLINKABLE GROUP AND PROCESS FOR PRODUCING THE SAME Mitsui Chemicals, Inc. (JP) 2001-10-24 EP disclosed