SCHEMBL3683337

SCHEMBL3683337

O=S(=O)(Cl)c1sc2ccc(Cl)cc2c1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
AKR1B1 P15121 1/20 0.39
IDO1 P14902 4/20 0.37
CMA1 P23946 6/20 0.37
PFKFB3 Q16875 4/20 0.37
PFKFB4 Q16877 4/20 0.37
TDO2 P48775 2/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL3692731 0.87 NPSR1 (0.41) KDM4ENPSR1L3MBTL1AKR1B1IDO1
SCHEMBL337593 0.76 NPSR1 (0.62) KDM4ENPSR1L3MBTL1AKR1B1CMA1
SCHEMBL3686803 0.76 KDM4E (0.46) KDM4ENPSR1L3MBTL1AKR1B1CMA1
SCHEMBL144003 0.73 MCL1 (0.42) KDM4EIDO1PFKFB3PFKFB4TDO2
SCHEMBL7472162 0.73 NPSR1 (0.45) KDM4ENPSR1L3MBTL1AKR1B1CMA1
SCHEMBL7539216 0.73 NPSR1 (0.45) KDM4ENPSR1L3MBTL1AKR1B1CMA1
SCHEMBL148094 0.73 MCL1 (0.53) KDM4EIDO1PFKFB3PFKFB4TDO2
SCHEMBL15147237 0.72 BCKDK (0.41) KDM4EIDO1PFKFB3PFKFB4TDO2
SCHEMBL160072 0.69 CMA1 (0.44) KDM4ENPSR1CMA1PFKFB3PFKFB4
SCHEMBL3684064 0.69 NPSR1 (0.44) NPSR1L3MBTL1AKR1B1CMA1PFKFB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7655641-B2 Sulfonamide derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2010-02-02 US disclosed
US-7655641-B2 Sulfonamide derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2010-02-02 US disclosed
US-7655641-B2 Sulfonamide derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2010-02-02 US disclosed
EP-1597248-B1 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS LILLY CO ELI (US) 2007-12-26 EP disclosed
EP-1597248-B1 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS LILLY CO ELI (US) 2007-12-26 EP disclosed
US-20060217433-A1 Sulfonamide derivatives as ppar modulators ELI LILLY AND COMPANY (US) 2006-09-28 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-20060217433-A1 Sulfonamide derivatives as ppar modulators PPARD, PPARA, PPARG KDM4E 3238/4885NPSR1 466/4885L3MBTL1 4653/4885

“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.