SCHEMBL4135963

SCHEMBL4135963

COCCCN(CCCCN(C)S(=O)(=O)c1ccccc1C#N)C(=O)NC(C)C

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
ALDH1A1 P00352 2/20 0.42
HTT P42858 1/20 0.42
GSTO1 P78417 2/20 0.40
BDKRB1 P46663 1/20 0.39
NR1H3 Q13133 1/20 0.39
MAPK1 P28482 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 1/20 0.36
HSD11B1 P28845 1/20 0.36
PTGES O14684 1/20 0.35
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
RORC P51449 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
SCHEMBL4135960 0.87 LMNA (0.43) LMNAALDH1A1HTTGSTO1BDKRB1
SCHEMBL4139487 0.83 LMNA (0.38) LMNAALDH1A1HTTGSTO1BDKRB1
SCHEMBL4139482 0.83 LMNA (0.38) LMNAALDH1A1HTTGSTO1BDKRB1
SCHEMBL4127774 0.82 KMT2A (0.45) LMNAALDH1A1HTTGSTO1BDKRB1
SCHEMBL5437654 0.71 HTT (0.57) LMNAALDH1A1HTTBDKRB1NR1H3
SCHEMBL3957305 0.70 HTT (0.60) LMNAALDH1A1HTTBDKRB1NR1H3
SCHEMBL4029806 0.70 ALDH1A1 (0.64) LMNAALDH1A1HTTGSTO1BDKRB1
SCHEMBL4145496 0.70 NPY5R (0.48) ALDH1A1HTT
SCHEMBL4127772 0.70 KMT2A (0.42) LMNAALDH1A1BDKRB1POLBHSD11B1
SCHEMBL5124833 0.69 BDKRB1 (0.56) LMNAALDH1A1HTTBDKRB1NR1H3

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-20090105259-A1 Acyclic 1,4-Diamines and Uses Thereof SMITHKLINE BEECHAM CORPORATION 2009-04-23 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-20090105259-A1 Acyclic 1,4-Diamines and Uses Thereof TRPV4, TRPC4, TRPV1 LMNA 3671/4885ALDH1A1 1565/4885HTT 1977/4885

“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.