SCHEMBL3046216

SCHEMBL3046216

CCCC(CCC)(CCC)[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
ALDH1A1 P00352 6/20 0.39
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 1/20 0.32
FDPS P14324 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
SCHEMBL15339686 0.86 ALDH1A1 (0.46) TSHRALDH1A1TDP1LMNAFDPS
SCHEMBL1117374 0.84 LMNA (0.42) TSHRALDH1A1TDP1LMNAFDPS
SCHEMBL1170692 0.84 LMNA (0.42) TSHRALDH1A1TDP1LMNAFDPS
SCHEMBL1117343 0.80 LMNA (0.39) TSHRALDH1A1LMNA
SCHEMBL393469 0.77
SCHEMBL1117310 0.77 ALDH1A1 (0.38) ALDH1A1LMNAFDPS
SCHEMBL2099935 0.76 LMNA (0.42) TSHRALDH1A1TDP1LMNA
SCHEMBL1117694 0.75 ALDH1A1 (0.37) ALDH1A1LMNAFDPS
SCHEMBL1117469 0.75 ALDH1A1 (0.39) ALDH1A1LMNAFDPS
SCHEMBL28415354 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4223315-A2 METHOD FOR SYNTHESIS OF REACTIVE CONJUGATE CLUSTERS Ionis Pharmaceuticals, Inc. (US) 2023-08-09 EP disclosed
EP-3811977-A1 METHOD FOR SYNTHESIS OF REACTIVE CONJUGATE CLUSTERS Ionis Pharmaceuticals, Inc. (US) 2021-04-28 EP disclosed
EP-3137115-B1 METHOD FOR SYNTHESIS OF REACTIVE CONJUGATE CLUSTERS IONIS PHARMACEUTICALS INC (US) 2020-10-14 EP disclosed
US-20170043025-A1 METHOD FOR SYNTHESIS OF REACTIVE CONJUGATE CLUSTERS IONIS PHARMACEUTICALS, INC. (US) 2017-02-16 US disclosed
US-7772431-B1 Performance of energy storage devices: potential areas for dendritic chemistry involvement NEWKOME GEORGE R 2010-08-10 US disclosed
US-7250534-B1 Performance of energy storage devices: potential areas for dendritic chemistry involvement UNIVERSITY OF SOUTH FLORIDA (US) 2007-07-31 US disclosed
WO-2001007497-A2 PERFORMANCE OF ENERGY STORAGE DEVICES: POTENTIAL AREAS FOR DENDRITIC CHEMISTRY INVOLVEMENT UNIVERSITY OF SOUTH FLORIDA (US) 2001-02-01 WO 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-20170043025-A1 METHOD FOR SYNTHESIS OF REACTIVE CONJUGATE CLUSTERS ACOT7, COASY, LCAT TSHR 1805/4885ALDH1A1 1477/4885TDP1 1673/4885

“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.