SCHEMBL18806403

SCHEMBL18806403

CNCCNC(=O)C(CCCN)NC(=O)C(CCCCN)NC

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.52
SIRT1 Q96EB6 1/20 0.52
NMT1 P30419 8/20 0.51
NMT2 O60551 7/20 0.51
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
TLR2 O60603 3/20 0.42
GNAI3 P08754 1/20 0.40
GNAO1 P09471 1/20 0.40
GNAI1 P63096 1/20 0.40
MMP1 P03956 1/20 0.40
MMP3 P08254 1/20 0.40
MMP9 P14780 1/20 0.40
CPB2 Q96IY4 1/20 0.39
CALCRL Q16602 1/20 0.38

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
SCHEMBL23685586 0.99 SIRT6 (0.53) SIRT6SIRT1NMT1NMT2CA1
SCHEMBL14004705 0.93 SIRT6 (0.51) SIRT6SIRT1NMT1NMT2CA1
SCHEMBL13997595 0.91 SIRT6 (0.46) SIRT6SIRT1NMT1NMT2CA1
SCHEMBL14004856 0.90 SIRT6 (0.52) SIRT6SIRT1NMT1NMT2CA1
SCHEMBL14004869 0.88 SIRT6 (0.43) SIRT6SIRT1NMT1NMT2CA1
SCHEMBL14002552 0.86 KISS1R (0.40) SIRT6SIRT1NMT1NMT2TLR2
SCHEMBL2560446 0.85 SIRT6 (0.70) SIRT6SIRT1NMT1NMT2CA1
SCHEMBL21944205 0.84 SIRT6 (0.47) SIRT6SIRT1NMT1NMT2CA1
SCHEMBL14002539 0.84 KISS1R (0.38) SIRT6SIRT1NMT1NMT2TLR2
SCHEMBL14004899 0.84 SIRT6 (0.49) SIRT6SIRT1NMT1NMT2CA1

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-20170119907-A1 Targeted Therapeutics MEDIVATION TECHNOLOGIES, INC. (US) 2017-05-04 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-20170119907-A1 Targeted Therapeutics ANXA3, ANXA5, ANXA6 SIRT6 2958/4885SIRT1 4333/4885NMT1 2825/4885

“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.