SCHEMBL3282209

SCHEMBL3282209

O=C(O)c1ccc2c(c1)CN(S(=O)(=O)c1ccc(F)c(F)c1)CC2

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 19/20 0.67
AKR1C1 Q04828 3/20 0.60
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54

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
SCHEMBL4012085 0.88 AKR1C3 (0.73) AKR1C3AKR1C1MEN1KMT2A
SCHEMBL3284957 0.85 AKR1C3 (0.73) AKR1C3AKR1C1
SCHEMBL3280649 0.84 AKR1C3 (0.76) AKR1C3AKR1C1MEN1KMT2A
SCHEMBL3282044 0.83 AKR1C3 (0.73) AKR1C3AKR1C1
SCHEMBL3281383 0.83 AKR1C3 (0.69) AKR1C3AKR1C1
SCHEMBL3287776 0.82 AKR1C3 (0.66) AKR1C3AKR1C1
SCHEMBL3282023 0.82 HDAC6 (0.71) AKR1C3AKR1C1
SCHEMBL3286988 0.82 AKR1C3 (0.73) AKR1C3AKR1C1MEN1KMT2A
SCHEMBL3284893 0.81 AKR1C3 (0.71) AKR1C3AKR1C1
SCHEMBL3282211 0.80 AKR1C3 (0.77) AKR1C3AKR1C1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7705017-B2 Compounds for treatment of neurodegenerative diseases EN VIVO PHARMACEUTICALS, INC. (US) 2010-04-27 US disclosed
US-20060004041-A1 Compounds for treatment of neurodegenerative diseases ENVIVO PHARMACEUTICALS, INC. 2006-01-05 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-20060004041-A1 Compounds for treatment of neurodegenerative diseases HDAC5, HDAC6, HDAC3 AKR1C3 1345/4885AKR1C1 1295/4885MEN1 3812/4885

“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.