SCHEMBL4797019

SCHEMBL4797019

N#CC(SC(=S)c1ccc(-c2ccccc2)cc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
HPGDS O60760 1/20 0.38
TRPA1 O75762 1/20 0.35
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
USP2 O75604 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
MAPT P10636 1/20 0.34
WDR5 P61964 1/20 0.34
ACP3 P15309 1/20 0.34
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
GAA P10253 1/20 0.34
ALOX12 P18054 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL237655 0.90 TSHR (0.44) TSHRTRPA1ALDH1A1SMN1; SMN2LMNA
SCHEMBL14293603 0.87 ESR1 (0.39) TSHRTRPA1ALDH1A1SMN1; SMN2LMNA
SCHEMBL4796278 0.86 TSHR (0.38) TSHRTRPA1ALDH1A1SMN1; SMN2LMNA
SCHEMBL4795088 0.86 LMNA (0.50) TSHRTRPA1ALDH1A1SMN1; SMN2LMNA
SCHEMBL14293717 0.83 TSHR (0.37) TSHRTRPA1ALDH1A1SMN1; SMN2LMNA
SCHEMBL4799974 0.82 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2LMNANPSR1USP2
SCHEMBL14267788 0.80 CES2 (0.39) TSHRALDH1A1SMN1; SMN2HPGDMAPT
SCHEMBL6690642 0.79 TSHR (0.47) TSHRTRPA1ALDH1A1SMN1; SMN2LMNA
SCHEMBL4801466 0.76 TSHR (0.44) TSHRTRPA1ALDH1A1SMN1; SMN2LMNA
SCHEMBL6692134 0.73 ALDH1A1 (0.40) TSHRTRPA1ALDH1A1SMN1; SMN2LMNA

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
US-7332552-B2 Low odor chain transfer agents for controlled radical polymerization RENSSELAER POLYTECHNIC INSTITUTE (US) 2008-02-19 US disclosed
US-7332552-B2 Low odor chain transfer agents for controlled radical polymerization RENSSELAER POLYTECHNIC INSTITUTE (US) 2008-02-19 US disclosed
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
US-20070088140-A1 Low odor chain transfer agents for controlled radical polymerization RENSSELAER POLYTECHNIC INSTITUTE 2007-04-19 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 2315/4885HPGDS 3071/4885TRPA1 81/4885

“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.