SCHEMBL6572002

SCHEMBL6572002

CCCS(=O)(=O)NCC(C)c1ccc2cc(O)ccc2c1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 8/20 0.51
HSD17B10 Q99714 2/20 0.42
CYP2C9 P11712 1/20 0.42
PTPN1 P18031 1/20 0.37
PTGS2 P35354 1/20 0.36
ABCB11 O95342 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TSHR P16473 1/20 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
SCHEMBL6575871 0.83 ABCB11 (0.54) GRIA4HSD17B10CYP2C9PTGS2ABCB11
SCHEMBL6565123 0.82 GRIA4 (0.68) GRIA4
SCHEMBL6572001 0.82 GRIA4 (0.55) GRIA4HSD17B10CYP2C9
SCHEMBL6759350 0.80 GRIA4 (0.47) GRIA4HSD17B10PTGS2ABCB11KDM4E
SCHEMBL5992695 0.78 GRIA4 (0.71) GRIA4
SCHEMBL6573583 0.78 GRIA4 (0.48) GRIA4HSD17B10PTGS2ABCB11KDM4E
SCHEMBL6763013 0.78 GRIA4 (0.43) GRIA4HSD17B10PTGS2ABCB11KDM4E
SCHEMBL6762651 0.77 GRIA4 (0.47) GRIA4HSD17B10CYP2C9PTGS2ABCB11
SCHEMBL6762961 0.76 KDM4E (0.44) GRIA4PTGS2KDM4E
SCHEMBL6763807 0.76 ALDH1A1 (0.47) GRIA4PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040147612-A1 Sulfonamide derivatives DAVISON JOSHUA ZWICK (US) 2004-07-29 US disclosed
EP-1409452-A1 SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2004-04-21 EP disclosed
WO-2002098846-A1 SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2002-12-12 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-20040147612-A1 Sulfonamide derivatives GRIN1, GRIN2A, GRIA1 GRIA4 9/4885HSD17B10 1260/4885CYP2C9 952/4885

“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.