SCHEMBL3208052

SCHEMBL3208052

O=C(O)NS(=O)(=O)NCCCCO

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.38
CA1 P00915 3/20 0.38
CA12 O43570 4/20 0.37
CA14 Q9ULX7 4/20 0.37
CA7 P43166 2/20 0.37
PPARA Q07869 2/20 0.36
FABP4 P15090 3/20 0.36
CA9 Q16790 1/20 0.36
GPR84 Q9NQS5 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL3208060 0.94 CA2 (0.38) CA2CA1CA12CA14CA7
SCHEMBL3215472 0.85 CYP2C19 (0.36) CA2CA1CA12CA14CA7
SCHEMBL12856641 0.82 CA1 (0.52) CA2CA1CA12CA14CA7
SCHEMBL3221256 0.82 CA2 (0.60) CA2CA1CA12CA14CA7
SCHEMBL7081057 0.80 CA2 (0.63) CA2CA1CA12CA14CA7
SCHEMBL7085537 0.80 CA2 (0.63) CA2CA1CA12CA14CA7
SCHEMBL5127346 0.79 CA2 (0.64) CA2CA1CA12CA14CA7
SCHEMBL3204486 0.75 MAPK1 (0.47) CA2CA1CA12CA14CA7
SCHEMBL3219367 0.75 ALDH1A1 (0.39) CA2CA1CA12CA14CA7
SCHEMBL12856657 0.74 CA1 (0.55) CA2CA1CA12CA14CA7

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-20100041892-A1 Therapeutic agent for diabetes ABE HIDENORI 2010-02-18 US disclosed
US-20090270631-A1 Therapeutic agent for diabetes ABE HIDENORI 2009-10-29 US disclosed
US-20080009530-A1 Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-10 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 (3 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-20090270631-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 CA2 1474/4885CA1 3460/4885CA12 3251/4885
US-20080009530-A1 Therapeutic Agent for Diabetes FABP4, SLC5A1, SLC5A2 CA2 1306/4885CA1 3746/4885CA12 3135/4885
US-20100041892-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 CA2 1474/4885CA1 3460/4885CA12 3251/4885

“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.