SCHEMBL4801484

SCHEMBL4801484

N#CC(OC(N)=S)c1ccccc1.NC(O)=S

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
TRPA1 O75762 1/20 0.38
ALDH1A1 P00352 4/20 0.35
MAPT P10636 2/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TDP1 Q9NUW8 2/20 0.33
NPSR1 Q6W5P4 3/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
PKM P14618 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
ALOX5 P09917 1/20 0.33
POLB P06746 1/20 0.32

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
SCHEMBL287345 0.80 SMN1; SMN2 (0.44) TSHRTRPA1ALDH1A1TDP1NPSR1
SCHEMBL4801417 0.80 TSHR (0.44) TSHRTRPA1ALDH1A1MAPTHSD17B10
SCHEMBL5932510 0.76 TSHR (0.44) TSHRTRPA1ALDH1A1TDP1NPSR1
SCHEMBL18978225 0.75 SRC (0.41) TSHRTRPA1ALDH1A1TDP1NPSR1
Thiobenzoic Acid SCHEMBL237656 0.75 TSHR (0.39) TSHRTRPA1ALDH1A1L3MBTL1TDP1
SCHEMBL5932426 0.74 TSHR (0.45) TSHRTRPA1ALDH1A1TDP1NPSR1
SCHEMBL6064417 0.73 LMNA (0.38) ALDH1A1NPSR1KDM4ESMN1; SMN2CYP1A2
SCHEMBL15453000 0.73 TSHR (0.44) TSHRTRPA1ALDH1A1TDP1NPSR1
SCHEMBL2835326 0.73 ALDH1A1 (0.50) TSHRTRPA1ALDH1A1MAPTHSD17B10
SCHEMBL7699172 0.73 ALDH1A1 (0.50) TSHRTRPA1ALDH1A1MAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7332552-B2 Low odor chain transfer agents for controlled radical polymerization RENSSELAER POLYTECHNIC INSTITUTE (US) 2008-02-19 US disclosed
US-20070088140-A1 Low odor chain transfer agents for controlled radical polymerization RENSSELAER POLYTECHNIC INSTITUTE 2007-04-19 US disclosed
WO-2004108770-A1 LOW ODOR CHAIN TRANSFER AGENTS FOR CONTROLLED RADICAL POLYMERIZATION RENSSELAER POLYTECHNIC INSTITUTE (US) 2004-12-16 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-20070088140-A1 Low odor chain transfer agents for controlled radical polymerization TAS2R43, CBR3, OR10J3 TSHR 2315/4885TRPA1 81/4885ALDH1A1 538/4885

“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.