SCHEMBL3773786

SCHEMBL3773786

CCCOc1cccc(I)c1S(N)(=O)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.45
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
CA9 Q16790 3/20 0.45
CA7 P43166 2/20 0.45
MCHR1 Q99705 1/20 0.40
CYP2A6 P11509 1/20 0.39
TSHR P16473 1/20 0.38
GAA P10253 3/20 0.38
HTR2B P41595 2/20 0.38
HTR2C P28335 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAPT P10636 3/20 0.35
LMNA P02545 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HTT P42858 2/20 0.35

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
SCHEMBL29469889 0.89 CA1 (0.51) CA12CA1CA2CA9CA7
SCHEMBL29469854 0.84 CA12 (0.47) CA12CA1CA2CA9CA7
SCHEMBL29469847 0.80 CA2 (0.44) CA12CA1CA2CA9CA7
SCHEMBL29469910 0.79 CA12 (0.43) CA12CA1CA2CA9CA7
SCHEMBL3772307 0.78 CA2 (0.45) CA12CA1CA2CA9CA7
SCHEMBL3776174 0.77 DRD1 (0.33) CA12CA1CA2CA9CA7
SCHEMBL1829415 0.74 CA1 (0.51) CA12CA1CA2CA9CA7
SCHEMBL9968957 0.74 CYP1A2 (0.47) MCHR1CYP2A6GAAHTR2BHTR2C
SCHEMBL29469878 0.73 CA1 (0.50) CA12CA1CA2CA9CA7
SCHEMBL1649916 0.73 CA1 (0.50) CA12CA1CA2CA9CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7855166-B2 Sulfonylamino(thio)carbonyl compounds BAYER CROPSCIENCE GMBH (DE) 2010-12-21 US disclosed
US-20100317524-A1 Sulfonylureas BAYER CROPSCIENCE AG (DE) 2010-12-16 US disclosed
CN-101166724-A Sulfonylamino (thio) carbonyl compounds in the form of herbicides or plant growth regulators BAYER CROPSCIENCE AG (DE) 2008-04-23 CN disclosed
CN-101166731-A Herbicidally active phenylsulfonylureas BAYER CROPSCIENCE AG (DE) 2008-04-23 CN disclosed
EP-1877386-A1 HERBICIDALLY ACTIVE PHENYLSULPHONYL-UREA Bayer CropScience AG (DE) 2008-01-16 EP disclosed
EP-1877380-A1 SULFONYLAMINO(THIO)CARBONYL COMPOUNDS IN THE FORM OF HERBICIDES OR PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2008-01-16 EP disclosed
US-20060264329-A1 Sulfonylureas BAYER CROPSCIENCE GMBH (DE) 2006-11-23 US disclosed
US-20060258536-A1 Sulfonylamino(thio)carbonyl compounds BAYER CROPSCIENCE GMBH (DE) 2006-11-16 US disclosed
EP-1717232-A1 Phenylsulfonylureas with herbicidal activity Bayer CropScience GmbH (DE) 2006-11-02 EP disclosed
EP-1717228-A1 Sulfonylamino(thio)carbonylderivatives as herbicides or plant growth regulators Bayer CropScience GmbH (DE) 2006-11-02 EP disclosed
WO-2006114221-A1 SULFONYLAMINO(THIO)CARBONYL COMPOUNDS IN THE FORM OF HERBICIDES OR PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2006-11-02 WO disclosed
WO-2006114220-A1 HERBICIDALLY ACTIVE PHENYLSULPHONYL-UREA BAYER CROPSCIENCE AG (DE) 2006-11-02 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 (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-20100317524-A1 Sulfonylureas IAPP, SLC5A2, SLC5A1 CA12 2065/4885CA1 1524/4885CA2 418/4885
US-20060258536-A1 Sulfonylamino(thio)carbonyl compounds TST, CBR3, MYB CA12 4407/4885CA1 4582/4885CA2 3775/4885
US-20060264329-A1 Sulfonylureas INSR, FFAR3, GPR119 CA12 2685/4885CA1 2058/4885CA2 1646/4885

“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.