SCHEMBL13750577

SCHEMBL13750577

CNS(=O)(=O)c1cc(C(=O)O)cc(C(=O)O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.66
LCK P06239 1/20 0.57
FYN P06241 1/20 0.57
WDR5 P61964 1/20 0.45
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GAA P10253 1/20 0.42
TPMT P51580 1/20 0.41
LMNA P02545 3/20 0.41
PTBP1 P26599 1/20 0.41
CA12 O43570 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41

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
SCHEMBL4782469 0.86 ALDH1A1 (0.51) CYP1A2LCKFYNSMN1; SMN2LMNA
SCHEMBL1510175 0.84 CYP1A2 (0.49) CYP1A2LCKFYNCA1CA2
SCHEMBL7608105 0.82 CYP1A2 (0.46) CYP1A2LCKFYNCA1CA2
SCHEMBL35539 0.81 CA1 (0.66) CA1CA2LMNAPTBP1TDP1
SCHEMBL30147625 0.81 CA1 (0.66) CA1CA2LMNAPTBP1TDP1
SCHEMBL2711811 0.80 ALDH1A1 (0.51) CYP1A2CA1CA2SMN1; SMN2GAA
SCHEMBL10611041 0.79 CYP1A2 (1.00) CYP1A2LCKFYNWDR5CA1
Dimethylamine SCHEMBL7141095 0.79 LCK (0.83) CYP1A2LCKFYNWDR5CA1
SCHEMBL1764031 0.79 SMN1; SMN2 (0.57) CA1CA2SMN1; SMN2GAALMNA
Dimethylamine SCHEMBL7141091 0.79 LCK (0.83) CYP1A2LCKFYNWDR5CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7572911-B2 Azo compound and process of producing the same, and novel compound and process of producing azo compounds using the same FUJIFILM CORPORATION (JP) 2009-08-11 US disclosed
US-20070173641-A1 Azo compound and process of producing the same, and novel compound and process of producing azo compounds using the same FUJI PHOTO FILM CO., LTD. 2007-07-26 US disclosed
US-7175268-B2 Inkjet recording ink and inkjet recording method FUJI PHOTO FILM CO., LTD. (JP) 2007-02-13 US 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-20070173641-A1 Azo compound and process of producing the same, and novel compound and process of producing azo compounds using the same CYP4A11, CYP4F11, CYP4X1 CYP1A2 14/4885LCK 3190/4885FYN 2959/4885

“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.