SCHEMBL6974524

SCHEMBL6974524

COc1ccc2[nH]nc(OS(=O)(=O)c3cccs3)c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTK P33981 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.41
LRRK2 Q5S007 1/20 0.40
HTR6 P50406 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HTT P42858 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
USP8 P40818 1/20 0.39
FADS1 O60427 1/20 0.38
CNR2 P34972 1/20 0.38
MAPT P10636 1/20 0.37
ITK Q08881 1/20 0.37
MAPK1 P28482 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 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
SCHEMBL6974868 0.80 TTK (0.50) TTKSMN1; SMN2LRRK2ALDH1A1HTT
SCHEMBL4740564 0.78 SMN1; SMN2 (0.56) TTKSMN1; SMN2TP53ALDH1A1HTT
SCHEMBL6975273 0.77 MAPT (0.51) TTKSMN1; SMN2TP53LRRK2ALDH1A1
SCHEMBL6970859 0.76 SMN1; SMN2 (0.49) TTKSMN1; SMN2LRRK2HTR6ALDH1A1
SCHEMBL6966594 0.76 TTK (0.46) TTKSMN1; SMN2LRRK2HTTKMT2A
SCHEMBL7082179 0.76 TTK (0.47) TTKHTR6ALDH1A1HTR2AKMT2A
SCHEMBL6978830 0.74 TTK (0.44) TTKSMN1; SMN2LRRK2HTR6HTT
SCHEMBL6977777 0.74 PRKAG1 (0.46) TTKALDH1A1KMT2AMEN1CNR2
SCHEMBL6979256 0.74 FADS1 (0.45) TTKLRRK2FADS1CNR2GAA
SCHEMBL6978269 0.73 MAPT (0.50) TTKSMN1; SMN2TP53HTR6ALDH1A1

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