SCHEMBL3554468

SCHEMBL3554468

CCN1CCN(c2ccc(S(C)(=O)=O)cc2N)CC1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.50
RAD52 P43351 3/20 0.50
MAPT P10636 2/20 0.50
GFER P55789 2/20 0.50
RAB9A P51151 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM2B Q8NHM5 1/20 0.48
DRD2 P14416 4/20 0.46
KDM4E B2RXH2 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA9 Q16790 2/20 0.42
DRD3 P35462 2/20 0.42
HTR6 P50406 2/20 0.42
HRH3 Q9Y5N1 2/20 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
SCHEMBL3435114 0.84 ALDH1A1 (0.46) RAB9AMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL31587411 0.82 RAB9A (0.70) GAAMAPTRAB9AMEN1KMT2A
SCHEMBL23850820 0.82 RAB9A (0.70) GAAMAPTRAB9AMEN1KMT2A
SCHEMBL3545115 0.81 KDM2B (0.46) GAARAD52MAPTGFERMEN1
SCHEMBL3616972 0.80 MEN1 (0.57) GAAMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL11554889 0.79 KDM4E (0.67) GAAMAPTRAB9AKDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL3619589 0.79 MEN1 (0.56) GAAMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL27861191 0.79 MAPT (0.71) GAARAD52MAPTGFERMEN1
SCHEMBL23850389 0.78 RAB9A (0.50) GAAMAPTRAB9AMEN1KMT2A
SCHEMBL10278255 0.77 MAPT (0.60) GAARAD52MAPTGFERKDM4E

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-8163746-B2 Azolecarboxamide derivative ASTELLAS PHARMA INC. (JP) 2012-04-24 US disclosed
US-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-11-19 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-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE GPR17, NTRK1, TRPV1 GAA 3904/4885RAD52 4165/4885MAPT 1330/4885

“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.