SCHEMBL5877891

SCHEMBL5877891

COc1ccc(C(=O)NCCc2ccc(-c3ccc(C(C)CNS(=O)(=O)C(C)C)cc3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 8/20 0.60
RAB9A P51151 4/20 0.51
NPC1 O15118 3/20 0.51
MAPT P10636 2/20 0.51
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
CACNA1B Q00975 1/20 0.49
APBA1 Q02410 1/20 0.49
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
LMNA P02545 3/20 0.48
GRIA2 P42262 1/20 0.48
OPRK1 P41145 1/20 0.47
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL5878575 0.89 GRIA4 (0.56) GRIA4RAB9ANPC1MAPTALDH1A1
SCHEMBL5877872 0.88 GRIA4 (0.62) GRIA4RAB9ANPC1MAPTMEN1
SCHEMBL5878181 0.88 GRIA4 (0.69) GRIA4RAB9ANPC1MAPTMEN1
SCHEMBL5878894 0.83 GRIA4 (0.68) GRIA4ALDH1A1SMN1; SMN2LMNAGRIA2
SCHEMBL5877779 0.82 GRIA4 (0.58) GRIA4ALDH1A1GRIA2
SCHEMBL6782455 0.82 GRIA4 (0.54) GRIA4RAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL5877766 0.82 GRIA4 (0.72) GRIA4RAB9ASMN1; SMN2GRIA2KDM4E
SCHEMBL5877621 0.81 GRIA4 (0.70) GRIA4RAB9AKMT2AGRIA2
SCHEMBL27570829 0.81 RAB9A (0.59) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL5878045 0.80 GRIA4 (0.58) GRIA4MAPTLMNAGRIA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7135487-B2 such as N-2-(4-Bromophenyl)propyl methanesulfonamide; sulfonamidation of the amine; glutamate receptor potentiators ELI LILLY AND COMPANY (US) 2006-11-14 US disclosed
US-20060030599-A1 SULPHONAMIDE DERIVATIVES ARNOLD MACKLIN B 2006-02-09 US disclosed
EP-1528055-A2 Sulphonamide Derivatives Eli Lilly & Company (US) 2005-05-04 EP disclosed
EP-0860428-B1 Sulphonamide derivatives LILLY CO ELI (US) 2004-12-08 EP disclosed
US-20040054009-A1 (BIS)sulfonamide derivatives KNOBELSDORF JAMES ALLEN (US) 2004-03-18 US disclosed
US-6596716-B2 2-propane-sulphonamide derivatives ELI LILLY AND COMPANY 2003-07-22 US disclosed
US-6525099-B1 Potentiating glutamate receptor function; psychiatric and neurological disorders ELI LILLY AND COMPANY 2003-02-25 US disclosed
US-20020002158-A1 Sulphonamide derivatives ARNOLD MACKLIN B (US) 2002-01-03 US disclosed
US-6303816-B1 Sulphonamide derivatives ELI LILLY AND COMPANY 2001-10-16 US disclosed
EP-0860428-A2 Sulphonamide derivatives ELI LILLY AND COMPANY (US) 1998-08-26 EP 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-20060030599-A1 SULPHONAMIDE DERIVATIVES GRIN2C, GLRA2, GLRA1 GRIA4 19/4885RAB9A 2770/4885NPC1 2454/4885
US-20020002158-A1 Sulphonamide derivatives GRIN2C, GRM1, GRM3 GRIA4 20/4885RAB9A 1988/4885NPC1 1676/4885
US-20040054009-A1 (BIS)sulfonamide derivatives GRIN2A, GRIN2B, GABRE GRIA4 14/4885RAB9A 1296/4885NPC1 3150/4885

“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.