SCHEMBL3685227

SCHEMBL3685227

CCCCCNS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.66
NPY1R P25929 1/20 0.65
NPY5R Q15761 1/20 0.65
LMNA P02545 2/20 0.60
GAA P10253 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
MAPK1 P28482 1/20 0.58
HTT P42858 1/20 0.58
POLB P06746 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
CYP19A1 P11511 1/20 0.56
HTR7 P34969 1/20 0.56

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
SCHEMBL9942078 0.98 NPY1R (0.67) ALDH1A1NPY1RNPY5RLMNAGAA
SCHEMBL3685286 0.95 ALDH1A1 (0.68) ALDH1A1NPY1RNPY5RLMNAGAA
SCHEMBL3687222 0.89 ALDH1A1 (0.65) ALDH1A1NPY1RNPY5RLMNAGAA
SCHEMBL30390387 0.85 ALDH1A1 (0.66) ALDH1A1NPY1RNPY5RLMNAGAA
SCHEMBL1928807 0.85 CYP1A2 (0.67) ALDH1A1NPY1RNPY5RLMNAGAA
SCHEMBL25759741 0.85 ALDH1A1 (0.66) ALDH1A1NPY1RNPY5RLMNAGAA
Hydrochloric Acid SCHEMBL1846589 0.84 CYP1A2 (0.66) ALDH1A1NPY1RNPY5RPOLB
SCHEMBL9927436 0.84 ALDH1A1 (0.68) ALDH1A1NPY1RNPY5RPOLB
SCHEMBL10194532 0.83 ALDH1A1 (0.68) ALDH1A1NPY1RNPY5RLMNAGAA
SCHEMBL6791530 0.83 ALDH1A1 (0.68) ALDH1A1NPY1RNPY5RLMNAGAA

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
WO-2021039824-A1 RNA METHYLTRANSFERASE INHIBITOR, SCREENING METHOD THEREFOR, ANTI-CANCER AGENT EFFICACY ASSESSMENT MARKER, AND KIT FOR EFFECTIVELY PREDICTING FTSJ1 INHIBITOR 国立大学法人 岡山大学 2021-03-04 WO 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
US-20060217433-A1 Sulfonamide derivatives as ppar modulators ELI LILLY AND COMPANY (US) 2006-09-28 US disclosed
EP-1597248-A2 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-11-23 EP disclosed
WO-2004073606-A2 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2004-09-02 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 (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 ALDH1A1 1050/4885NPY1R 495/4885NPY5R 567/4885

“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.