SCHEMBL5658385

SCHEMBL5658385

CS(=O)(=O)OCCc1ccccc1OCCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
CA9 Q16790 2/20 0.49
DRD2 P14416 2/20 0.47
HTR1A P08908 1/20 0.47
ABCB1 P08183 2/20 0.46
MGLL Q99685 1/20 0.43
CYP19A1 P11511 1/20 0.43
DRD1 P21728 1/20 0.42
DRD4 P21917 1/20 0.42
DRD5 P21918 1/20 0.42
HRH1 P35367 1/20 0.42
CA12 O43570 1/20 0.42
CA7 P43166 1/20 0.42

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
SCHEMBL24041895 0.93 HTR1A (0.46) CA1CA2CA9DRD2HTR1A
SCHEMBL5660413 0.88 HTR1A (0.59) DRD2HTR1AABCB1MGLL
SCHEMBL5250473 0.87 HTR1A (0.54) DRD2HTR1AABCB1
SCHEMBL5657713 0.85 L3MBTL1 (0.46)
SCHEMBL6589802 0.84 CA1 (0.66) CA1CA2CA9CA12CA7
SCHEMBL4860922 0.83 L3MBTL1 (0.56)
SCHEMBL24041822 0.82 BCHE (0.44) CA1CA2CA9ABCB1CA12
Ammonia Solution, Strong SCHEMBL28745712 0.82 CA1 (0.63) CA1CA2CA9CA12CA7
SCHEMBL24041835 0.81 L3MBTL1 (0.52) ABCB1
SCHEMBL5658392 0.81 TP53 (0.47) DRD2HTR1AABCB1CYP19A1HRH1

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-7166617-B2 Cyclic amide derivatives MITSUBISHI PHARMA CORPORATION (JP) 2007-01-23 US disclosed
US-20030212094-A1 Novel cyclic amide derivatives MITSUBISHI PHARMA CORPORATION (JP) 2003-11-13 US disclosed
EP-1260512-A1 NOVEL CYCLIC AMIDE DERIVATIVES Mitsubishi Pharma Corporation (JP) 2002-11-27 EP 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-20030212094-A1 Novel cyclic amide derivatives SIGMAR1, OPRM1, OPRD1 CA1 4571/4885CA2 3770/4885CA9 4580/4885

“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.