SCHEMBL3689324

SCHEMBL3689324

Cc1sc2ccc(Cl)cc2c1S(=O)(=O)Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
HTR6 P50406 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CYP2A6 P11509 1/20 0.42
HTR1A P08908 1/20 0.41
HTR1D P28221 1/20 0.41
HTR1B P28222 1/20 0.41
HTR2C P28335 1/20 0.41
HTR7 P34969 1/20 0.41
HTR2B P41595 1/20 0.41
AKR1B1 P15121 1/20 0.41
ROCK1 Q13464 2/20 0.41
PIM1 P11309 1/20 0.40
PIM2 Q9P1W9 1/20 0.40
PFKFB4 Q16877 3/20 0.39
CMA1 P23946 4/20 0.39
PFKFB3 Q16875 3/20 0.39
CA2 P00918 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL3947527 0.87 HTR6 (0.45) KDM4EHTR6NPSR1L3MBTL1CYP2A6
SCHEMBL13881544 0.87 HTR6 (0.45) KDM4EHTR6NPSR1L3MBTL1CYP2A6
SCHEMBL6957613 0.77 ACLY (0.44) KDM4EL3MBTL1MAPT
SCHEMBL337593 0.77 NPSR1 (0.62) KDM4ENPSR1L3MBTL1AKR1B1ROCK1
SCHEMBL13119265 0.76 CYP2A6 (0.52) KDM4ENPSR1L3MBTL1CYP2A6AKR1B1
SCHEMBL8295552 0.74 ROCK1 (0.56) KDM4ENPSR1L3MBTL1CYP2A6AKR1B1
SCHEMBL7473168 0.73 HTR6 (0.41) HTR6CA2
SCHEMBL10431976 0.72 CYP2A6 (0.47) KDM4ENPSR1L3MBTL1CYP2A6AKR1B1
SCHEMBL3224602 0.71 NPSR1 (0.40) KDM4ENPSR1L3MBTL1CYP2A6AKR1B1
SCHEMBL3686803 0.70 KDM4E (0.46) KDM4ENPSR1L3MBTL1CYP2A6AKR1B1

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-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
EP-1228066-A2 SULFONAMIDE DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 2002-08-07 EP disclosed
WO-2001032646-A2 SULFONAMIDE DERIVATIVES SMITHKLINE BEECHAM P.L.C. (GB) 2001-05-10 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-20060217433-A1 Sulfonamide derivatives as ppar modulators PPARD, PPARA, PPARG KDM4E 3238/4885HTR6 1897/4885NPSR1 466/4885

“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.