SCHEMBL8972947

SCHEMBL8972947

Cc1c(N=Nc2ccc(N)c(S(=O)(=O)O)c2)c(O)n(C)c(=O)c1C#N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 10/20 0.56
▸ MAPT P10636 10/20 0.56
▸ MEN1 O00255 9/20 0.56
▸ ALDH1A1 P00352 4/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ PKM P14618 1/20 0.47
▸ KDM4E B2RXH2 5/20 0.41
▸ MITF O75030 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ SENP2 Q9HC62 4/20 0.38
▸ SUMO2 P61956 3/20 0.38
▸ SUMO1 P63165 3/20 0.38
▸ SENP7 Q9BQF6 3/20 0.38
▸ SENP1 Q9P0U3 3/20 0.38
▸ SENP3 Q9H4L4 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ GLO1 Q04760 1/20 0.36
▸ ENPP2 Q13822 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
SCHEMBL8779943 0.88 MAPT (0.48) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL10615204 0.82 KMT2A (0.48) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL9817121 0.79 MAPT (0.51) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL9817126 0.79 MAPT (0.51) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL18335257 0.78 MAPT (0.54) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL18335256 0.78 MAPT (0.54) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL10184550 0.77 MAPT (0.65) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL13759100 0.77 MAPT (0.47) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL11058973 0.76 KMT2A (0.56) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL11058970 0.76 KMT2A (0.56) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0481449-B1 Ink compositions for ink jet recording SUMITOMO CHEMICAL CO (JP) 1996-03-27 — — EP disclosed
US-5183501-A A water-soluble azo, phthalocyanine, anthraquinone, dioxazine or formazan dye having one or more-SO2-CH2-CH2-SO3H groups, a solvent and water; heat and water resistance; colorfastness SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-02-02 — — US disclosed
EP-0481449-A2 Ink compositions for ink jet recording SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-04-22 — — EP disclosed
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