SCHEMBL13744495

SCHEMBL13744495

COCCNC(=O)COC

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
HPGD P15428 6/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2C19 P33261 2/20 0.51
CYP2C9 P11712 1/20 0.51
ALDH1A1 P00352 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
KDM4E B2RXH2 1/20 0.49
GLA P06280 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SPR P35270 1/20 0.45
POLB P06746 1/20 0.44
CNR1 P21554 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
HTT P42858 1/20 0.42
CA2 P00918 1/20 0.42
ATM Q13315 1/20 0.42

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
SCHEMBL8536337 0.88 TSHR (0.45) TSHRHPGDCYP1A2CYP2C19CYP2C9
SCHEMBL2730627 0.87 SPR (0.49) TSHRHPGDALDH1A1KDM4ESPR
SCHEMBL8537552 0.86 MEN1 (0.48) TSHRHPGDCYP1A2CYP2C19CYP2C9
SCHEMBL8537710 0.86 MEN1 (0.48) TSHRHPGDCYP1A2CYP2C19CYP2C9
SCHEMBL14253421 0.86 TSHR (0.70) TSHRHPGDALDH1A1TDP1KDM4E
SCHEMBL12323498 0.85 TSHR (0.47) TSHRHPGDCYP1A2CYP2C19CYP2C9
SCHEMBL8326097 0.83 TSHR (0.54) TSHRALDH1A1KDM4ESPRPOLB
SCHEMBL23478140 0.83 TSHR (0.65) TSHRHPGDCYP1A2CYP2C19CYP2C9
SCHEMBL18858805 0.83 HPGD (0.46) TSHRHPGDCYP1A2CYP2C19CYP2C9
SCHEMBL14253417 0.81 TSHR (0.40) TSHRHPGDCYP1A2CYP2C19CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11274083-B2 Substituted thiophenyl uracils, salts thereof and the use thereof as herbicidal agents SYNGENTA CROP PROTECTION AG (CH) 2022-03-15 US disclosed
EP-3728235-B1 SUBSTITUTED THIOPHENYLURACILS , THEIR SALTS AND USE OF SAID COMPOUNDS AS HERBICIDAL AGENTS SYNGENTA CROP PROTECTION AG (CH) 2022-02-09 EP disclosed
US-20210087151-A1 SUBSTITUTED THIOPHENYL URACILS, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS SYNGENTA CROP PROTECTION AG (CH) 2021-03-25 US disclosed
WO-2016113167-A1 SUBSTITUTED BENZIMIDAZOLIUM COMPOUNDS USEFUL IN THE TREATMENT OF RESPIRATORY DISEASES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-07-21 WO disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 US disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 US disclosed
US-7531537-B2 Benzofuran derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-05-12 US disclosed
US-7348424-B2 Polysaccharide containing phosphorylcholine group and process for producing the same SHISEIDO COMPANY, LTD. (JP) 2008-03-25 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 (3 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-11274083-B2 Substituted thiophenyl uracils, salts thereof and the use thereof as herbicidal agents UNG, TYMP, TYMS TSHR 901/4885HPGD 1792/4885CYP1A2 548/4885
US-20210087151-A1 SUBSTITUTED THIOPHENYL URACILS, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS UNG, TYMP, TYMS TSHR 901/4885HPGD 1792/4885CYP1A2 548/4885
US-20090209511-A1 Benzofuran Derivatives F12, F2, F3 TSHR 2452/4885HPGD 850/4885CYP1A2 87/4885

“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.