SCHEMBL21669904

SCHEMBL21669904

CCCCCCCC(C)(CCCCCCC)N(CCC)CCCC

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.36
TSHR P16473 1/20 0.35
THRB P10828 1/20 0.35
GGPS1 O95749 6/20 0.33
FDPS P14324 9/20 0.32
CNR2 P34972 1/20 0.32
CES2 O00748 1/20 0.31
LPAR1 Q92633 1/20 0.31
LPAR3 Q9UBY5 1/20 0.31
SMPD1 P17405 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
SCHEMBL24854979 0.96 DNM1 (0.41) DNM1TSHRTHRBGGPS1FDPS
Hydrochloric Acid SCHEMBL29102035 0.89 DNM1 (0.46) DNM1TSHRTHRBGGPS1FDPS
SCHEMBL23084861 0.89 DNM1 (0.37) DNM1TSHRTHRBGGPS1FDPS
SCHEMBL23377631 0.87 DNM1 (0.36) DNM1TSHRTHRBGGPS1FDPS
SCHEMBL24368445 0.83 DNM1 (0.46) DNM1TSHRFDPSSMPD1
SCHEMBL21941313 0.83 DNM1 (0.46) DNM1TSHRFDPSSMPD1
SCHEMBL21179492 0.81 TSHR (0.42) DNM1TSHRTHRBGGPS1FDPS
SCHEMBL18722279 0.81 TSHR (0.42) DNM1TSHRTHRBGGPS1FDPS
SCHEMBL28460650 0.81 TSHR (0.42) DNM1TSHRTHRBGGPS1FDPS
SCHEMBL28521973 0.81 TSHR (0.42) DNM1TSHRTHRBGGPS1FDPS

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-20200039943-A1 COMPOUNDS, DEVICES, AND USES THEREOF SIGILON THERAPEUTICS, INC. 2020-02-06 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-20200039943-A1 COMPOUNDS, DEVICES, AND USES THEREOF SLC10A1, SLCO1B3, SLC5A1 DNM1 4354/4885TSHR 2004/4885THRB 439/4885

“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.