SCHEMBL7040949

SCHEMBL7040949

CN(C)S(=O)(=O)Oc1ccc(-c2ccc(C3CCC(=O)N3C(=O)O)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 13/20 0.40
CA12 O43570 11/20 0.40
RAB9A P51151 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.37
CA1 P00915 11/20 0.35
CA9 Q16790 11/20 0.35
CA4 P22748 3/20 0.35
KMT2A Q03164 2/20 0.33
CCNB2 O95067 1/20 0.33
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33
CCNB3 Q8WWL7 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL7043551 0.78 AKR1C3 (0.38) CA2CA12L3MBTL1CA1CA9
SCHEMBL6701246 0.76 HCRTR1 (0.46) L3MBTL1
SCHEMBL4133494 0.76 HCRTR1 (0.46) L3MBTL1
SCHEMBL4145312 0.70 L3MBTL1 (0.47) L3MBTL1ALDH1A1LMNA
SCHEMBL7041726 0.70 CA2 (0.41) CA2CA12RAB9ACA1CA9
SCHEMBL7043219 0.70 DRD2 (0.40) CA2CA12L3MBTL1CA1CA9
SCHEMBL7132988 0.68 AKR1C3 (0.37) CA2CA12CA1CA9CA4
SCHEMBL7046052 0.68 CA2 (0.59) CA2CA12RAB9AL3MBTL1CA1
SCHEMBL7080163 0.68 RAB9A (0.38) CA2CA12RAB9AL3MBTL1KMT2A
SCHEMBL7193226 0.65 GPR119 (0.50) L3MBTL1

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-20030220386-A1 Delta 1-pyrrolines for use as pesticides BAYER CROPSCIENCE AG (DE) 2003-11-27 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-20030220386-A1 Delta 1-pyrrolines for use as pesticides DDT, OPRD1, PRMT1 CA2 2815/4885CA12 4621/4885RAB9A 370/4885

“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.