SCHEMBL347363

SCHEMBL347363

O=[N+]([O-])c1ccc(-c2cccc3ccccc23)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
ALDH1A1 P00352 4/20 0.52
SMN1; SMN2 Q16637 1/20 0.51
MAPT P10636 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
PSD A5PKW4 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 1/20 0.48
HPGD P15428 1/20 0.48
IDO1 P14902 1/20 0.48
APP P05067 1/20 0.47
LMNA P02545 1/20 0.47
HTR7 P34969 1/20 0.47
TNKS O95271 1/20 0.47

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
SCHEMBL29524122 0.91 ALDH1A1 (0.58) CA12CA1CA2CA9ALDH1A1
SCHEMBL6797845 0.83 NPC1 (0.54) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL13374618 0.81 MAPT (0.47) CA12CA1CA2CA9ALDH1A1
SCHEMBL28240316 0.81 ALDH1A1 (0.58) CA12CA1CA2CA9ALDH1A1
SCHEMBL3798335 0.80 CA12 (0.62) CA12CA1CA2CA9ALDH1A1
SCHEMBL30640138 0.80 PRKCZ (0.59) ALDH1A1SMN1; SMN2MAPTTDP1MEN1
SCHEMBL14988489 0.80 PRKCZ (0.59) ALDH1A1SMN1; SMN2MAPTTDP1MEN1
SCHEMBL11481629 0.80 SMN1; SMN2 (0.50) ALDH1A1SMN1; SMN2MAPTTDP1MEN1
SCHEMBL28260078 0.80 SMN1; SMN2 (0.50) ALDH1A1SMN1; SMN2MAPTTDP1MEN1
SCHEMBL6393406 0.79 PTPRC (0.65) ALDH1A1MAPTTDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-19 US disclosed
US-8048982-B2 Method for producing aromatic compound polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-01 US disclosed
CN-101265147-B Method for preparing biaryl UNIV SHANGHAI JIAOTONG 2011-05-11 CN disclosed
CN-101001900-B Process for producing aromatic compound polymer SUMITOMO CHEMICAL CO 2011-04-20 CN disclosed
CN-101914111-A The preparation method of aromatic compound polymer SUMITOMO CHEMICAL CO 2010-12-15 CN disclosed
EP-2241548-A1 Vanadium di-nuclear complex Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
EP-2241547-A1 Method for producing aromatic compound polymer Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
US-20090018309-A1 Method for Producing Aromatic Compound Polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-15 US disclosed
CN-101265147-A Method for preparing biaryl UNIV SHANGHAI JIAOTONG (CN) 2008-09-17 CN disclosed
CN-101001900-A Process for producing aromatic compound polymer SUMITOMO CHEMICAL CO (JP) 2007-07-18 CN disclosed
EP-1767560-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER Sumitomo Chemical Company, Limited (JP) 2007-03-28 EP disclosed
CN-1006386-B PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER SHINETSU CHEM IND CO (JP) 1990-01-10 CN disclosed
CN-85107531-A Process for producing vinyl chloride polymer 1987-01-21 CN 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 (2 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-20090018309-A1 Method for Producing Aromatic Compound Polymer PAH, MAOA, AHR CA12 1989/4885CA1 2804/4885CA2 1431/4885
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER PAH, MAOA, AHR CA12 1977/4885CA1 2812/4885CA2 1450/4885

“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.