SCHEMBL7127420

SCHEMBL7127420

CC(C)(C)OC(=O)NCCc1c(O)ccc2c1C(S(=O)(=O)c1ccccc1)CS2(O)O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.39
CA2 P00918 11/20 0.38
CA1 P00915 9/20 0.38
NQO2 P16083 1/20 0.38
CA12 O43570 5/20 0.37
CA9 Q16790 5/20 0.37
NAMPT P43490 1/20 0.36
MALT1 Q9UDY8 1/20 0.35
SIGMAR1 Q99720 2/20 0.35
ACACB O00763 1/20 0.35

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
SCHEMBL7127202 0.92 HDAC1 (0.36) IDO1CA2CA1CA12CA9
SCHEMBL7127418 0.91 IDO1 (0.39) IDO1CA2CA1NQO2CA12
SCHEMBL7126887 0.83 DRD2 (0.36) IDO1CA2CA1CA12CA9
SCHEMBL7127208 0.82 HDAC1 (0.36) IDO1CA2CA1CA12CA9
SCHEMBL7131539 0.81 CA1 (0.44) IDO1CA2CA1CA12CA9
SCHEMBL7166193 0.81 CA1 (0.45) IDO1CA2CA1CA12CA9
SCHEMBL7134803 0.80 CA1 (0.37) IDO1CA2CA1NQO2CA12
SCHEMBL7249512 0.80 SIGMAR1 (0.37) IDO1CA2CA1CA12CA9
SCHEMBL7132936 0.78 CA12 (0.41) IDO1CA2CA1CA12CA9
SCHEMBL7132941 0.78 CA12 (0.41) IDO1CA2CA1CA12CA9

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-20030073706-A1 Fused thiophone derivatives and drugs containing the same as the active ingredient KONISHI MIKIO (JP) 2003-04-17 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-20030073706-A1 Fused thiophone derivatives and drugs containing the same as the active ingredient TPMT, CD47, THPO IDO1 4214/4885CA2 3155/4885CA1 2040/4885

“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.