SCHEMBL2734280

SCHEMBL2734280

CCCCCCCCCCCCCCCCCCCCCCCc1cccs1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.57
TSHR P16473 1/20 0.50
MEN1 O00255 1/20 0.46
GAPDH P04406 1/20 0.46
POLB P06746 1/20 0.46
ALOX15 P16050 1/20 0.46
NR4A1 P22736 1/20 0.46
APEX1 P27695 1/20 0.46
PTPN7 P35236 1/20 0.46
BLM P54132 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 2/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL2734233 1.00 TAAR1 (0.57) TAAR1TSHRMEN1GAPDHPOLB
SCHEMBL271943 1.00 TAAR1 (0.57) TAAR1TSHRMEN1GAPDHPOLB
SCHEMBL272288 1.00 TAAR1 (0.57) TAAR1TSHRMEN1GAPDHPOLB
SCHEMBL2734409 1.00 TAAR1 (0.57) TAAR1TSHRMEN1GAPDHPOLB
SCHEMBL271561 1.00 TAAR1 (0.57) TAAR1TSHRMEN1GAPDHPOLB
SCHEMBL272341 1.00 TAAR1 (0.57) TAAR1TSHRMEN1GAPDHPOLB
SCHEMBL23407 1.00 TAAR1 (0.57) TAAR1TSHRMEN1GAPDHPOLB
SCHEMBL270626 1.00 TAAR1 (0.57) TAAR1TSHRMEN1GAPDHPOLB
SCHEMBL271466 1.00 TAAR1 (0.57) TAAR1TSHRMEN1GAPDHPOLB
SCHEMBL25851 1.00 TAAR1 (0.57) TAAR1TSHRMEN1GAPDHPOLB

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-7906147-B2 superparamagnetic nanoparticles of iron coated with bilayer of molecules:(a) layer of oleic acid in direct contact with the iron particles; (b) a layer of Tween\"; bilayer of surface binding molecules and amphiphatic molecules; self-assembles; solubilizing; reducing toxicity; gold in MRI and tomography NANOPROBES, INC. (US) 2011-03-15 US disclosed
US-20080089836-A1 superparamagnetic nanoparticles of iron coated with bilayer of molecules:(a) layer of oleic acid in direct contact with the iron particles; (b) a layer of Tween\"; bilayer of surface binding molecules and amphiphatic molecules; self-assembles; solubilizing; reducing toxicity; gold in MRI and tomography NANOPROBES, INC. (US) 2008-04-17 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-20080089836-A1 superparamagnetic nanoparticles of iron coated with bilayer of molecules:(a) layer of oleic acid in direct contact with the iron particles; (b) a layer of Tween\"; bilayer of surface binding molecules and amphiphatic molecules; self-assembles; solubilizing; reducing toxicity; gold in MRI and tomography TFRC, FABP1, SCARB1 TAAR1 1013/4885TSHR 1345/4885MEN1 1197/4885

“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.