SCHEMBL710698

SCHEMBL710698

CCCC(O)OS(=O)(=O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 0.34
CA14 Q9ULX7 1/20 0.34
HDAC1 Q13547 2/20 0.32
HDAC2 Q92769 2/20 0.32
CHRM1 P11229 1/20 0.32
AKR1A1 P14550 1/20 0.32
CHRM3 P20309 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
ADRA1A P35348 1/20 0.32
HRH1 P35367 1/20 0.32
DRD3 P35462 1/20 0.32
SLC6A3 Q01959 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32

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
Ammonia Solution, Strong SCHEMBL11352450 0.98 TP53 (0.33) TP53CA12CA1CA2CA7
SCHEMBL211159 0.86 TP53 (0.41) TP53CA1CA2FDPS
SCHEMBL710699 0.83 CA12 (0.35) TP53CA12CA1CA2CA7
SCHEMBL6383892 0.83 TP53 (0.31) TP53CA12CA1CA2CA7
SCHEMBL22749156 0.83 TP53 (0.47) TP53FDPS
SCHEMBL5081945 0.81 TP53 (0.46) TP53FDPS
SCHEMBL23631862 0.81 ALDH1A1 (0.40) TP53CA12CA1CA2CA7
SCHEMBL5155590 0.80
SCHEMBL9767506 0.79 CYP3A4 (0.34) CA12CA1CA2CA7CA14
SCHEMBL28426127 0.78 CA2 (0.35) TP53CA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1908582-B1 GAS BARRIER LAMINATE FOR USE IN HOT WATER TREATMENT MITSUBISHI CHEM CORP (JP) 2018-06-13 EP disclosed
WO-2015021079-A1 PROTECTED FLUORESCENT REAGENT COMPOUNDS PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2015-02-12 WO disclosed
US-20140194392-A1 DRUG SCREENING METHOD NATIONAL CHIAO TUNG UNIVERSITY (TW) 2014-07-10 US disclosed
US-8124236-B2 Gas-barrier laminate for hydrothermal treatment MITSUBISHI PLASTICS, INC. (JP) 2012-02-28 US disclosed
EP-1942132-B1 LAMINATE FILM TORAY INDUSTRIES (JP) 2011-09-07 EP disclosed
US-7972700-B2 Laminated film TORAY INDUSTRIES, INC. (JP) 2011-07-05 US disclosed
US-20100239868-A1 Laminated Film TORAY INDUSTRIES, INC., A CORPORATION OF JAPAN (JP) 2010-09-23 US disclosed
US-20100035050-A1 GAS-BARRIER LAMINATE FOR HYDROTHERMAL TREATMENT MITSUBISHI PLASTICS, INC. (JP) 2010-02-11 US disclosed
EP-1942132-A1 LAMINATE FILM TORAY INDUSTRIES, INC. (JP) 2008-07-09 EP disclosed
EP-1908582-A1 GAS BARRIER LAMINATE FOR USE IN HOT WATER TREATMENT MITSUBISHI PLASTICS INC. (JP) 2008-04-09 EP disclosed
EP-0960900-B1 Thermoplastic laminate film TOYO BOSEKI (JP) 2004-01-14 EP disclosed
US-6649260-B2 Optical coating film TOYO BOSEKI KABUSHIKI KAISHA (JP) 2003-11-18 US disclosed
US-20020106506-A1 Optical coating film TOYO BOSEKI KABUSHIKI KAISHA 2002-08-08 US disclosed
EP-1215228-A2 Optical coating film TOYO BOSEKI KABUSHIKI KAISHA (JP) 2002-06-19 EP disclosed
EP-0960900-A2 Thermoplastic laminate film Toyo Boseki Kabushiki Kaisha (JP) 1999-12-01 EP disclosed
EP-0201715-B1 SURFACE-TREATED POLYESTER FILM TEIJIN LIMITED (JP) 1991-12-18 EP disclosed
US-4755337-A Coating with crosslinkable aqueous primer containing polyurethane and polyepoxy compound before crystallizing and orienting, drying, stretching, heating TEIJIN LIMITED (JP) 1988-07-05 US disclosed
EP-0201715-A2 Surface-treated polyester film TEIJIN LIMITED (JP) 1986-11-20 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140194392-A1 DRUG SCREENING METHOD ABCG2, ABCB1, TP53 TP53 3/4885CA12 4359/4885CA1 4721/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.