SCHEMBL6977903

SCHEMBL6977903

COc1ccc2c(c1)c(OCc1ccc(OCc3ccccc3)cc1)nn2S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.46
MAPT P10636 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CD4 P01730 2/20 0.43
PIR O00625 1/20 0.43
CNR2 P34972 4/20 0.43
CNR1 P21554 2/20 0.43
MAOB P27338 1/20 0.43
ACHE P22303 2/20 0.43
TP53 P04637 1/20 0.42
HTR6 P50406 4/20 0.42
BCHE P06276 1/20 0.42
DRD2 P14416 2/20 0.42
HTR7 P34969 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
GABRA1 P14867 2/20 0.41

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
SCHEMBL6977906 0.88 CNR2 (0.40) MEN1KMT2ACNR2CNR1MAOB
SCHEMBL6962516 0.87 MAPT (0.45) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL6969933 0.86 ALDH1A1 (0.45) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL6973700 0.85 HTR6 (0.45) KDM4EALDH1A1CNR2CNR1MAOB
SCHEMBL6965738 0.84 MAPT (0.44) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL6969751 0.82 SGMS1 (0.47) KMT2AALDH1A1TP53HTR6DRD2
SCHEMBL6962722 0.81 HTR6 (0.41) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL6962715 0.81 HTR6 (0.41) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL6975027 0.80 HTR6 (0.45) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL6970785 0.79 LMNA (0.49) MAPTMEN1KMT2AKDM4EALDH1A1

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