SCHEMBL7699809

SCHEMBL7699809

Cc1ccccc1-c1nc(S(=O)(=O)c2ccc(Br)cc2)c(NCc2ccc(F)cc2)o1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.74
KDM4E B2RXH2 4/20 0.74
HTT P42858 1/20 0.74
MAPT P10636 7/20 0.59
POLB P06746 2/20 0.55
PKM P14618 1/20 0.55
HPGD P15428 1/20 0.55
KMT2A Q03164 3/20 0.53
GAA P10253 1/20 0.52
TSHR P16473 1/20 0.52
MEN1 O00255 1/20 0.52
LMNA P02545 1/20 0.50
TP53 P04637 2/20 0.49

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
SCHEMBL7697447 0.92 ALDH1A1 (0.82) ALDH1A1KDM4EHTTMAPTPOLB
SCHEMBL7695043 0.92 MAPT (0.63) ALDH1A1KDM4EHTTMAPTPOLB
SCHEMBL7695177 0.89 ALDH1A1 (0.66) ALDH1A1KDM4EHTTMAPTPOLB
SCHEMBL7696898 0.86 MAPT (0.58) ALDH1A1KDM4EHTTMAPTKMT2A
SCHEMBL7697517 0.85 ALDH1A1 (0.70) ALDH1A1KDM4EHTTMAPTPOLB
SCHEMBL7695048 0.83 ALDH1A1 (0.66) ALDH1A1KDM4EHTTMAPTPOLB
SCHEMBL7698848 0.83 ALDH1A1 (0.68) ALDH1A1KDM4EHTTMAPTPOLB
SCHEMBL7695231 0.81 ALDH1A1 (0.66) ALDH1A1KDM4EHTTMAPTPOLB
SCHEMBL7704674 0.80 MAPT (0.69) ALDH1A1KDM4EHTTMAPTHPGD
SCHEMBL7700628 0.80 MAPT (0.76) ALDH1A1KDM4EHTTMAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002100842-A1 SULFONYLOXAZOLAMINES AND THEIR USE AS 5-HT6 LIGANDS MERCK PATENT GMBH (DE) 2002-12-19 WO disclosed