SCHEMBL15218271

SCHEMBL15218271

Cc1ccc(S(=O)(=O)COCC(COCO)(COCO)COCNC(=O)OC(C)(C)C)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 8/20 0.38
CA2 P00918 8/20 0.38
CA12 O43570 5/20 0.38
CA9 Q16790 5/20 0.38
ALDH1A1 P00352 6/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MAPT P10636 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
TSHR P16473 1/20 0.35
LMNA P02545 1/20 0.34
CCNC P24863 1/20 0.34
CDK8 P49336 1/20 0.34
ADAM17 P78536 1/20 0.34

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
SCHEMBL15218273 0.84 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1MAPTCYP3A4
SCHEMBL15218276 0.80 TDP1 (0.45) CA1CA2CA12CA9KMT2A
SCHEMBL13201475 0.75 ALDH1A1 (0.55) CA1CA2CA12CA9ALDH1A1
SCHEMBL15218272 0.74 TDP1 (0.35) KMT2AMEN1TDP1
SCHEMBL1926110 0.73 CA1 (0.52) CA1CA2CA12CA9ALDH1A1
SCHEMBL30069900 0.72 ALDH1A1 (0.45) CA1CA2CA12CA9ALDH1A1
SCHEMBL28578349 0.71 CA1 (0.53) CA1CA2CA12CA9ALDH1A1
SCHEMBL5241017 0.69 CA1 (0.57) CA1CA2CA12CA9ALDH1A1
SCHEMBL6509909 0.68 CA1 (0.43) CA1CA2CA12CA9ALDH1A1
SCHEMBL25848715 0.67 ALDH1A1 (0.54) CA1CA2CA12CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130225789-A1 Polyethylene Glycol Having Hetero Multiple Functional Groups SUN YI (US) 2013-08-29 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-20130225789-A1 Polyethylene Glycol Having Hetero Multiple Functional Groups CLTB, GMFG, HDGF CA1 3367/4885CA2 4687/4885CA12 1422/4885

“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.