SCHEMBL14199812

SCHEMBL14199812

O=C(O)c1ccc2c(c1)S(=O)(=O)c1cc(C(=O)O)ccc1C2=O

nearest known ligand 0.84

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.84
KMT2A Q03164 5/20 0.61
MEN1 O00255 3/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
TTR P02766 1/20 0.56
ALDH1A1 P00352 5/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
HPGD P15428 2/20 0.51
NPC1 O15118 1/20 0.51
PTPRC P08575 2/20 0.50
LMNA P02545 1/20 0.49
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL10626360 0.93 CHEK1 (0.79) CHEK1KMT2AMEN1L3MBTL1TTR
SCHEMBL1152020 0.92 CHEK1 (1.00) CHEK1KMT2AMEN1L3MBTL1TTR
SCHEMBL11667243 0.90 CHEK1 (0.97) CHEK1KMT2AMEN1L3MBTL1TTR
SCHEMBL2706112 0.90 CHEK1 (0.69) CHEK1KMT2AMEN1L3MBTL1TTR
SCHEMBL29789038 0.90 CHEK1 (0.69) CHEK1KMT2AMEN1L3MBTL1TTR
SCHEMBL31365268 0.86 CHEK1 (0.65) CHEK1KMT2AMEN1L3MBTL1TTR
SCHEMBL11629994 0.86 CHEK1 (0.69) CHEK1KMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL11633736 0.86 CHEK1 (0.69) CHEK1KMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL10625641 0.86 CHEK1 (0.69) CHEK1KMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL11636020 0.85 CHEK1 (0.68) CHEK1KMT2AMEN1L3MBTL1TTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7351461-B2 Articles comprising benzopyran colorants, method of manufacture, and method of use GENERAL ELECTRIC COMPANY (US) 2008-04-01 US disclosed
US-20070238817-A1 Articles Comprising Benzopyran Colorants, Method Of Manufacture, And Method Of Use GENERAL ELECTRIC COMPANY (US) 2007-10-11 US disclosed
US-7270772-B2 Benzopyran colorants, method of manufacture, and method of use GENERAL ELECTRIC COMPANY (US) 2007-09-18 US disclosed
US-20070122746-A1 BENZOPYRAN COLORANTS, METHOD OF MANUFACTURE, AND METHOD OF USE SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2007-05-31 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 (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-20070122746-A1 BENZOPYRAN COLORANTS, METHOD OF MANUFACTURE, AND METHOD OF USE CBR3, CBR1, NQO1 CHEK1 2089/4885KMT2A 3492/4885MEN1 1330/4885
US-20070238817-A1 Articles Comprising Benzopyran Colorants, Method Of Manufacture, And Method Of Use CBR3, CBR1, HCCS CHEK1 2050/4885KMT2A 3462/4885MEN1 1635/4885

“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.