SCHEMBL8418696

SCHEMBL8418696

Cc1cc(=O)n(-c2ccc(S(=O)(=O)O)cc2)[nH]1.Cc1cc(=O)n(-c2ccccc2)[nH]1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.59
▸ ALDH1A1 P00352 8/20 0.59
▸ KMT2A Q03164 7/20 0.59
▸ HTT P42858 6/20 0.59
▸ KDM4E B2RXH2 5/20 0.59
▸ MEN1 O00255 5/20 0.59
▸ GAA P10253 4/20 0.59
▸ SMN1; SMN2 Q16637 5/20 0.58
▸ TDP1 Q9NUW8 1/20 0.58
▸ LMNA P02545 4/20 0.52
▸ RECQL P46063 1/20 0.52
▸ CYP2C19 P33261 2/20 0.52
▸ POLB P06746 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ TSHR P16473 2/20 0.43
▸ ALKBH5 Q6P6C2 1/20 0.42
▸ ALKBH3 Q96Q83 1/20 0.41
▸ CYP1A2 P05177 1/20 0.40

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
SCHEMBL395368 0.94 ALDH1A1 (0.66) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL11316773 0.91 ALDH1A1 (0.55) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL10654204 0.87 ALDH1A1 (0.60) MAPTALDH1A1KMT2AHTTKDM4E
Methyl Alcohol SCHEMBL1028813 0.85 MAPT (0.69) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL34121 0.84 ALDH1A1 (0.68) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL9150171 0.84 ALDH1A1 (0.68) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL5425653 0.84 ALDH1A1 (0.68) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL393039 0.84 ALDH1A1 (0.53) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL10698670 0.84 ALDH1A1 (0.53) MAPTALDH1A1KMT2AHTTKDM4E
SCHEMBL10607053 0.82 ALDH1A1 (0.54) MAPTALDH1A1KMT2AHTTKDM4E

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-0804510-B1 MONOAZO PIGMENTS ZENECA LTD (GB) 1999-09-08 — — EP claimed
US-5037449-A For dyeing or printing cotton or wool CIBA-GEIGY CORPORATION (US) 1991-08-06 — — US disclosed
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