SCHEMBL16468652

SCHEMBL16468652

O=S(=O)(CCc1cc(O)c(O)c(O)c1)CS(=O)(=O)CCc1cc(O)c(O)c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.44
SERPINE1 P05121 2/20 0.35
SELL P14151 3/20 0.34
SELP P16109 3/20 0.34
SELE P16581 2/20 0.34
TRPV1 Q8NER1 1/20 0.33
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPT P10636 3/20 0.32
TDP1 Q9NUW8 3/20 0.32
APEX1 P27695 2/20 0.32
RECQL P46063 2/20 0.32
LMNA P02545 2/20 0.32
TP53 P04637 2/20 0.32
MAPK1 P28482 2/20 0.32
SNCA P37840 2/20 0.32
HSD17B10 Q99714 2/20 0.32
NSD2 O96028 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
SCHEMBL5377166 0.80 ALOX15 (0.55) CA2KDM4EALDH1A1MAPTTDP1
SCHEMBL5454316 0.75 CA2 (0.40) CA2CA12CA1CA7CA9
SCHEMBL23000978 0.68 HTR2A (0.45) CA2TRPV1MAPK1HTTCA1
SCHEMBL17138365 0.67 TDP1 (0.62) KDM4EALDH1A1MAPTTDP1APEX1
SCHEMBL328576 0.67 TDP1 (0.62) KDM4EALDH1A1MAPTTDP1APEX1
3,4,5-Trihydroxyphenethyl Alcohol SCHEMBL2990691 0.67 KDM4E (0.58) CA2SERPINE1SELLSELPSELE
SCHEMBL14495267 0.67 CA2 (0.77) CA2MMP12MMP13KDM4EALDH1A1
SCHEMBL7497047 0.67 NPC1 (0.43) SERPINE1SELLSELPSELEMAPK1
Water SCHEMBL17686500 0.66 TDP1 (0.60) KDM4EALDH1A1MAPTTDP1APEX1
SCHEMBL723983 0.66 LTA4H (0.58) POLB

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-20160346287-A1 METHOD OF TREATING VIRAL INFECTIONS EPIPHANY BIOSCIENCES, INC. 2016-12-01 US claimed
US-20150050241-A1 METHOD OF TREATING VIRAL INFECTIONS EPIPHANY BIOSCIENCES, INC. 2015-02-19 US claimed
US-20160346287-A1 METHOD OF TREATING VIRAL INFECTIONS EPIPHANY BIOSCIENCES, INC. 2016-12-01 US disclosed
US-20150050241-A1 METHOD OF TREATING VIRAL INFECTIONS EPIPHANY BIOSCIENCES, INC. 2015-02-19 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-20160346287-A1 METHOD OF TREATING VIRAL INFECTIONS IFNG, BCL9, GDA CA2 2556/4885SERPINE1 4302/4885SELL 4436/4885
US-20150050241-A1 METHOD OF TREATING VIRAL INFECTIONS IFNG, BCL9, GDA CA2 2556/4885SERPINE1 4302/4885SELL 4436/4885

“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.