SCHEMBL6977194

SCHEMBL6977194

COc1ccc2c(c1)c(OCCOc1ccccc1Br)nn2S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.45
MAPT P10636 8/20 0.42
KMT2A Q03164 6/20 0.42
ALDH1A1 P00352 4/20 0.42
MEN1 O00255 3/20 0.42
KDM4E B2RXH2 2/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
LMNA P02545 2/20 0.41
NPC1 O15118 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
RAB9A P51151 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
DRD2 P14416 1/20 0.37
HTR2A P28223 1/20 0.37
HTR7 P34969 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
SCHEMBL6962516 0.88 MAPT (0.45) HTR6MAPTKMT2AALDH1A1MEN1
SCHEMBL6969933 0.85 ALDH1A1 (0.45) HTR6MAPTKMT2AALDH1A1MEN1
SCHEMBL6967275 0.84 HTR6 (0.42) HTR6MAPTKMT2AALDH1A1MEN1
SCHEMBL6975027 0.83 HTR6 (0.45) HTR6MAPTKMT2AALDH1A1MEN1
SCHEMBL6967417 0.82 HTR6 (0.41) HTR6MAPTKMT2AALDH1A1MEN1
SCHEMBL6971803 0.82 HTR6 (0.41) HTR6MAPTKMT2AALDH1A1MEN1
SCHEMBL6967992 0.82 HTR6 (0.39) HTR6MAPTKMT2AALDH1A1MEN1
SCHEMBL6975698 0.82 HTR6 (0.39) HTR6MAPTKMT2AALDH1A1MEN1
SCHEMBL6968042 0.81 KMT2A (0.43) HTR6MAPTKMT2AALDH1A1MEN1
SCHEMBL6971624 0.80 HTR6 (0.41) HTR6MAPTKMT2AALDH1A1MEN1

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 claimed
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