SCHEMBL4384528

SCHEMBL4384528

CS(=O)(=O)OCCCNC(=C(C#N)C#N)N1CCC(N2CCCCC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 10/20 0.36
L3MBTL1 Q9Y468 9/20 0.36
MBTD1 Q05BQ5 7/20 0.34
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 2/20 0.32
TP53BP1 Q12888 2/20 0.32
L3MBTL4 Q8NA19 1/20 0.32
DRD2 P14416 1/20 0.31
DRD3 P35462 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL4394086 0.81 L3MBTL3 (0.37) L3MBTL3L3MBTL1MBTD1ALDH1A1KMT2A
SCHEMBL4383145 0.78 L3MBTL1 (0.51) L3MBTL3L3MBTL1TSHRKMT2ADRD2
SCHEMBL4381114 0.78 L3MBTL1 (0.51) L3MBTL3L3MBTL1TSHRKMT2ADRD2
SCHEMBL4383372 0.76 L3MBTL3 (0.42) L3MBTL3L3MBTL1MBTD1TSHRTP53BP1
SCHEMBL4386340 0.75 HRH3 (0.39) L3MBTL3L3MBTL1ALDH1A1TSHR
SCHEMBL4388125 0.74 GAA (0.45) L3MBTL3L3MBTL1ALDH1A1TSHRKMT2A
SCHEMBL4388918 0.72 L3MBTL3 (0.41) L3MBTL3L3MBTL1DRD2DRD3
SCHEMBL4383440 0.72 L3MBTL3 (0.44) L3MBTL3L3MBTL1ALDH1A1TSHRKMT2A
SCHEMBL4384521 0.71 L3MBTL3 (0.39) L3MBTL3L3MBTL1DRD2DRD3
SCHEMBL4384524 0.71

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-20090181948-A1 DIAMINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-07-16 US disclosed
EP-1847530-A1 DIAMINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-10-24 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-20090181948-A1 DIAMINE DERIVATIVE ARG1, PRMT5, PRMT1 L3MBTL3 1965/4885L3MBTL1 2665/4885MBTD1 3597/4885

“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.