Benzene

Benzene

SCHEMBL6746153

O=S(=O)(O)Nc1ccccc1.c1ccccc1

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.58
KEAP1 Q14145 2/20 0.58
CA1 P00915 2/20 0.58
IL1RN P18510 1/20 0.56
ERAP1 Q9NZ08 1/20 0.56
ACP1 P24666 2/20 0.54
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
PKM P14618 1/20 0.52
PTPN2 P17706 1/20 0.49
PTPN1 P18031 1/20 0.49
PTPRA P18433 1/20 0.49
PTPRB P23467 1/20 0.49
PGR P06401 1/20 0.47
CA12 O43570 3/20 0.47
CA9 Q16790 3/20 0.47
TSHR P16473 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TMPRSS6 Q8IU80 2/20 0.44

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
SCHEMBL146561 1.00 CA2 (0.58) CA2KEAP1CA1IL1RNERAP1
Ammonia Solution, Strong SCHEMBL4592850 0.97 KEAP1 (0.56) CA2KEAP1CA1IL1RNERAP1
SCHEMBL29756025 0.97 CA2 (0.56) CA2KEAP1CA1IL1RNERAP1
SCHEMBL28176614 0.97 CA2 (0.56) CA2KEAP1CA1IL1RNERAP1
Methane SCHEMBL3339448 0.97 CA2 (0.56) CA2KEAP1CA1IL1RNERAP1
SCHEMBL3213812 0.97 CA2 (0.56) CA2KEAP1CA1IL1RNERAP1
Hydrochloric Acid SCHEMBL5069950 0.97 CA2 (0.56) CA2KEAP1CA1IL1RNERAP1
Formaldehyde SCHEMBL28212330 0.95 CA2 (0.54) CA2KEAP1CA1IL1RNERAP1
Chloromethane SCHEMBL11386742 0.93 KEAP1 (0.58) CA2KEAP1CA1IL1RNERAP1
Sulfamate SCHEMBL11079904 0.93 CA1 (0.64) CA2KEAP1CA1IL1RNERAP1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8142503-A None JP disclosed
JP-61003780-A None JP disclosed
JP-6227149-A None JP disclosed
EP-1040933-B1 Double-side recording medium OJI PAPER CO (JP) 2004-03-03 EP disclosed
EP-1040933-A1 Double-side recording medium OJI PAPER CO., LTD. (JP) 2000-10-04 EP disclosed
EP-0701905-B1 Thermosensitive reversible colordeveloping and disappearing agent OJI PAPER CO (JP) 1998-12-23 EP disclosed
US-5702850-A COMPRISES A COLOR-DEVELOPING AROMATIC COMPOUND REACTIVE WITH A COLORLESS DYE PRECURSOR OF RECORDING MATERIAL TO DEVELOP COLOR ON HEATING AND TO MAKE COLOR DISAPPEAR UPON HEATING AT LOWER TERMPERATURE THAN PREVIOUS COLOR DEVELOPING TEMPERATURE NEW OJI PAPER CO., LTD. (JP) 1997-12-30 US disclosed
JP-H08142503-A COUPLER COMPOSITION FOR PRESSURE-SENSITIVE RECORDING AND PRESSURE-SENSITIVE RECORDING SHEET MITSUI TOATSU CHEM INC 1996-06-04 JP disclosed
EP-0701905-A1 Thermosensitive reversible colordeveloping and disappearing agent NEW OJI PAPER CO., LTD. (JP) 1996-03-20 EP disclosed
JP-H06227149-A THERMAL RECORDING BODY NEW OJI PAPER CO LTD 1994-08-16 JP disclosed
EP-0136678-B1 HEAT SENSITIVE RECORD MATERIAL HODOGAYA CHEMICAL CO., LTD. (JP) 1989-09-13 EP disclosed
EP-0155796-B1 6-TETRAHYDROFURFURYLAMINOFLUORAN COMPOUND USEFUL AS A COLOR FORMER HODOGAYA CHEMICAL CO., LTD. (JP) 1988-09-14 EP disclosed
US-4694088-A Fluoran compounds HODOGAYA CHEMICAL CO., LTD. (JP) 1987-09-15 US disclosed
US-4642663-A 6-tetrahydrofurfurylaminofluoran compound useful as a color former on an heat sensitive recording sheet HODOGAYA CHEMICAL CO., LTD. (JP) 1987-02-10 US disclosed
US-4612558-A XANTHENE, LEUCO DYES HODOGAYA CHEMICAL CO., LTD. (JP) 1986-09-16 US disclosed
US-4597795-A HEAT SENSITIVE RECORDING HODOGAYA CHEMICAL CO., LTD. (JP) 1986-07-01 US disclosed
JP-S613780-A THERMAL RECORDING MATERIAL RICOH CO LTD 1986-01-09 JP disclosed
EP-0156250-A2 Fluoran compounds HODOGAYA CHEMICAL CO., LTD. (JP) 1985-10-02 EP disclosed
US-4539577-A Heat sensitive record material HODOGAYA CHEMICAL CO., LTD. (JP) 1985-09-03 US disclosed
EP-0136678-A2 Heat sensitive record material HODOGAYA CHEMICAL CO., LTD. (JP) 1985-04-10 EP disclosed