SCHEMBL7918975

SCHEMBL7918975

O=C(O)C(F)Oc1ccc(SCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.47
GAA P10253 2/20 0.46
MEN1 O00255 7/20 0.45
KMT2A Q03164 7/20 0.45
MAPT P10636 5/20 0.45
TSHR P16473 2/20 0.45
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RAB9A P51151 1/20 0.42
SLC1A3 P43003 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
NFKB1 P19838 1/20 0.40
PMP22 Q01453 1/20 0.40

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
SCHEMBL7911893 0.91 ALDH1A1 (0.47) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL7924095 0.87 ALDH1A1 (0.62) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL7920847 0.87 ALDH1A1 (0.56) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL7920706 0.86 ALDH1A1 (0.53) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL7924028 0.86 ALDH1A1 (0.62) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL7918672 0.86 ALDH1A1 (0.50) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL7911840 0.86 ALDH1A1 (0.62) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL7918793 0.86 ALDH1A1 (0.46) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL7918909 0.82 ALDH1A1 (0.56) ALDH1A1GAAMEN1KMT2AMAPT
SCHEMBL7924132 0.79 ALDH1A1 (0.55) ALDH1A1GAAMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0811375-B1 GLUTAMIC ACID RECEPTOR AGONIST NIPPON SUISAN KAISHA LTD (JP) 2001-01-03 EP disclosed
EP-0811375-A1 GLUTAMIC ACID RECEPTOR AGONIST NIPPON SUISAN KAISHA, LTD. (JP) 1997-12-10 EP disclosed
EP-0469901-B1 Sulfonamide derivatives TAISHO PHARMACEUTICAL CO LTD (JP) 1994-10-19 EP disclosed
EP-0469901-A1 Sulfonamide derivatives TAISHO PHARMACEUTICAL CO. LTD (JP) 1992-02-05 EP disclosed