SCHEMBL6979256

SCHEMBL6979256

COc1ccc2[nH]nc(OS(=O)(=O)c3cc(Cl)ccc3Cl)c2c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FADS1 O60427 1/20 0.45
ALPL P05186 3/20 0.42
TTK P33981 1/20 0.42
FBP1 P09467 1/20 0.41
ALPI P09923 2/20 0.39
GSK3B P49841 1/20 0.38
LRRK2 Q5S007 1/20 0.38
AKR1B1 P15121 1/20 0.38
CNR2 P34972 1/20 0.38
SGK1 O00141 4/20 0.37
GAA P10253 1/20 0.37
CNR1 P21554 1/20 0.37

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
SCHEMBL6966594 0.85 TTK (0.46) FADS1ALPLTTKALPILRRK2
SCHEMBL6974868 0.79 TTK (0.50) FADS1TTKGSK3BLRRK2AKR1B1
SCHEMBL7082179 0.77 TTK (0.47) FADS1TTKCNR2CNR1
SCHEMBL6975273 0.76 MAPT (0.51) TTKLRRK2CNR2GAA
SCHEMBL6970859 0.75 SMN1; SMN2 (0.49) TTKLRRK2CNR2GAA
SCHEMBL6978269 0.75 MAPT (0.50) TTK
SCHEMBL6974524 0.74 TTK (0.45) FADS1TTKLRRK2CNR2GAA
SCHEMBL6978830 0.73 TTK (0.44) FADS1TTKLRRK2CNR2CNR1
SCHEMBL6977777 0.73 PRKAG1 (0.46) TTKGSK3BCNR2GAA
SCHEMBL17683325 0.71 FADS1 (0.45) FADS1LRRK2CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077947-B1 NOVEL 1,5 AND 3-O-SUBSTITUTED 1H-INDAZOLES WITH ANTI-ASTHMATIC, ANTI-ALLERGIC, ANTI-INFLAMMATORY, IMMUNO-MODULATING AND NEURO-PROTECTIVE EFFECT, METHOD FOR THE PRODUCTION AND USE THEREOF AS MEDICAMENTS DRESDEN ARZNEIMITTEL (DE) 2003-09-03 EP disclosed
US-6166023-A 1,5- and 3-O-substituted 1H-indazoles having anti-asthmatic, anti-allergic, anti-inflammatory, immunomodulating and neuroprotective action, process for their preparation and their use as medicaments ARZNEIMITTELWERK DRESDEN GMBH (DE) 2000-12-26 US disclosed