SCHEMBL11698299

SCHEMBL11698299

Cc1cc(=O)n(-c2ccccc2)[nH]1.Nc1cc(Cl)cc(S(=O)(=O)O)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.47
GAA P10253 6/20 0.47
ALDH1A1 P00352 5/20 0.47
KMT2A Q03164 5/20 0.47
HTT P42858 4/20 0.47
MEN1 O00255 4/20 0.47
KDM4E B2RXH2 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
LMNA P02545 3/20 0.40
POLB P06746 1/20 0.40
BLM P54132 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MPL P40238 4/20 0.40
RECQL P46063 1/20 0.40
ALKBH5 Q6P6C2 1/20 0.36
THRB P10828 1/20 0.36
TSHR P16473 1/20 0.36
ACLY P53396 1/20 0.35

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
SCHEMBL11697702 0.89 MAPT (0.41) MAPTGAAALDH1A1KMT2AHTT
SCHEMBL7698334 0.88 ALDH1A1 (0.48) MAPTGAAALDH1A1KMT2AHTT
SCHEMBL11415506 0.83 MAPT (0.43) MAPTGAAALDH1A1KMT2AHTT
SCHEMBL11213912 0.80 MAPT (0.52) MAPTGAAALDH1A1KMT2AHTT
SCHEMBL11822938 0.78 ALDH1A1 (0.47) MAPTGAAALDH1A1KMT2AHTT
SCHEMBL11361767 0.78 MPL (0.54) MAPTGAAALDH1A1KMT2AHTT
SCHEMBL11584649 0.77 MAPT (0.52) MAPTGAAALDH1A1KMT2AHTT
Questiomycin B SCHEMBL11210024 0.76 MAPT (0.59) MAPTGAAALDH1A1KMT2AHTT
SCHEMBL8418696 0.76 MAPT (0.59) MAPTGAAALDH1A1KMT2AHTT
Methyl Alcohol SCHEMBL1028813 0.75 MAPT (0.69) MAPTGAAALDH1A1KMT2AHTT

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
US-4045424-A Salt of a sulfonic acid substituted 1:2 metal complex dye with a basic dye and an amine BASF AKTIENGESELLSCHAFT (DT) 1977-08-30 US disclosed