SCHEMBL6936039

SCHEMBL6936039

CC(=O)Oc1c(Br)cccc1[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.43
GPR35 Q9HC97 1/20 0.43
TSHR P16473 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 6/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
HSP90AA1 P07900 1/20 0.40
ATM Q13315 1/20 0.40
POLB P06746 2/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
THRB P10828 1/20 0.39
ERN1 O75460 1/20 0.39
CYP2D6 P10635 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL27542157 0.82 TDP1 (0.54) TDP1GPR35TSHRL3MBTL1ALDH1A1
SCHEMBL4090307 0.81 HSPB1 (0.47) TDP1GPR35TSHRL3MBTL1ALDH1A1
SCHEMBL9646427 0.80 KDM4E (0.48) TDP1TSHRL3MBTL1ALDH1A1MAPT
SCHEMBL26113210 0.80 ALDH1A1 (0.42) TDP1GPR35L3MBTL1ALDH1A1MAPT
SCHEMBL30079450 0.80 TDP1 (0.52) TDP1GPR35TSHRL3MBTL1ALDH1A1
SCHEMBL1707141 0.80 TDP1 (0.52) TDP1GPR35TSHRL3MBTL1ALDH1A1
SCHEMBL10629321 0.79 MAOB (0.45) TDP1GPR35TSHRL3MBTL1ALDH1A1
SCHEMBL8579575 0.79 ALDH1A1 (0.57) TDP1TSHRL3MBTL1ALDH1A1MAPT
SCHEMBL27664107 0.79 KDM4E (0.59) TDP1GPR35TSHRL3MBTL1ALDH1A1
SCHEMBL28106336 0.79 MAPT (0.40) TDP1GPR35L3MBTL1ALDH1A1MAPT

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-20030225127-A1 Heterocyclic sulfonamide derivatives BENDER DAVID MICHAEL (US) 2003-12-04 US disclosed
US-20030220369-A1 Heterocyclic sulfonamide derivatives and their use for potentiating glutamate receptor function FORMAN SCOTT LOUIS (US) 2003-11-27 US disclosed
EP-1313719-A2 HETEROCYCLIC SULFONAMIDE DERIVATIVES AND THEIR USE FOR POTENTIATING GLUTAMATE RECEPTOR FUNCTION ELI LILLY AND COMPANY (US) 2003-05-28 EP disclosed
EP-1309577-A2 HETEROCYCLIC SULFONAMIDE DERIVATIVES AND THEIR USE FOR POTENTIATING GLUTAMATE RECEPTOR FUNCTION ELI LILLY AND COMPANY (US) 2003-05-14 EP disclosed
WO-2002014294-A2 HETEROCYCLIC SULFONAMIDE DERIVATIVES AND THEIR USE FOR POTENTIATING GLUTAMATE RECEPTOR FUNCTION ELI LILLY AND COMPANY (US) 2002-02-21 WO disclosed
WO-2002014275-A2 HETEROCYCLIC SULFONAMIDE DERIVATIVES AND THEIR USE FOR POTENTIATING GLUTAMATE RECEPTOR FUNCTION ELI LILLY AND COMPANY (US) 2002-02-21 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 (2 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-20030225127-A1 Heterocyclic sulfonamide derivatives GRIN2A, GRIN2B, GRIN1 TDP1 3131/4885GPR35 138/4885TSHR 546/4885
US-20030220369-A1 Heterocyclic sulfonamide derivatives and their use for potentiating glutamate receptor function GRIN2A, GRIN1, GRIN2B TDP1 3424/4885GPR35 94/4885TSHR 365/4885

“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.