SCHEMBL2534149

SCHEMBL2534149

CCOC(=O)c1cc(O)c(O)cc1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.65
CA1 P00915 5/20 0.65
CA2 P00918 5/20 0.65
CA7 P43166 5/20 0.65
CA9 Q16790 5/20 0.65
CA14 Q9ULX7 5/20 0.65
TSHR P16473 3/20 0.55
HSP90AA1 P07900 1/20 0.55
NR1H2 P55055 1/20 0.55
NR1H3 Q13133 1/20 0.55
ALDH1A1 P00352 5/20 0.52
TDP1 Q9NUW8 2/20 0.52
HSD17B10 Q99714 2/20 0.52
HPGD P15428 1/20 0.52
ALOX15 P16050 1/20 0.52
RECQL P46063 1/20 0.52
CYP3A4 P08684 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MAPT P10636 4/20 0.49
KMT2A Q03164 3/20 0.49

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
SCHEMBL322149 0.96 CA12 (0.69) CA12CA1CA2CA7CA9
SCHEMBL28451530 0.94 CA12 (0.67) CA12CA1CA2CA7CA9
SCHEMBL9129292 0.88 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL8167665 0.88 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL796110 0.88 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL28446948 0.86 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL15959314 0.86 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL24894280 0.85 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL1952844 0.85 CA1 (0.57) CA12CA1CA2CA7CA9
SCHEMBL24894581 0.85 CA12 (0.57) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8044098-B2 Use of e.g. 2,4-dihydroxybenzoic acid or 3,4,5-trihydroxybenzoic acid or esters thereof; hepatitis B virus (HBV), papillomavirus and/or herpes virus SHENGHUA GUANGZHOU PHARMACEUTICAL SCIENCE & TECHNOLOGY CO., LTD. (CN) 2011-10-25 US disclosed
US-20080119550-A1 Use of e.g. 2,4-dihydroxybenzoic acid or 3,4,5-trihydroxybenzoic acid or esters thereof; hepatitis B virus (HBV), papillomavirus and/or herpes virus SHENGHUA GUANGZHOU PHARMACEUTICAL SCIENCE & TECHNOLOGY CO., LTD. (CN) 2008-05-22 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-20080119550-A1 Use of e.g. 2,4-dihydroxybenzoic acid or 3,4,5-trihydroxybenzoic acid or esters thereof; hepatitis B virus (HBV), papillomavirus and/or herpes virus ETV1, ETV6, CYP8B1 CA12 1220/4885CA1 2914/4885CA2 3054/4885

“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.