SCHEMBL13763487

SCHEMBL13763487

Cc1ccc(N=Nc2ccc(N=Nc3cc(S(=O)(=O)O)c4cc(S(=O)(=O)O)cc(S(=O)(=O)O)c4c3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ SENP2 Q9HC62 7/20 0.46
▸ SUMO2 P61956 5/20 0.46
▸ SUMO1 P63165 5/20 0.46
▸ SENP7 Q9BQF6 5/20 0.46
▸ ATIC P31939 2/20 0.46
▸ PHLPP2 Q6ZVD8 2/20 0.44
▸ POLB P06746 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ SENP1 Q9P0U3 5/20 0.42
▸ SENP3 Q9H4L4 3/20 0.42
▸ BRD4 O60885 1/20 0.40
▸ RPS6KA3 P51812 1/20 0.40
▸ MAPT P10636 3/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ APP P05067 1/20 0.40
▸ THRB P10828 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
SCHEMBL7869667 0.85 SENP2 (0.52) CYP1A2CYP2C9SENP2SUMO2SUMO1
SCHEMBL7107286 0.85 SENP2 (0.52) CYP1A2CYP2C9SENP2SUMO2SUMO1
SCHEMBL18218118 0.84 SENP2 (0.64) CYP1A2CYP2C9SENP2SUMO2SUMO1
SCHEMBL12112427 0.82 CYP1A2 (0.54) CYP1A2CYP2C9SENP2SUMO2SUMO1
SCHEMBL3714721 0.81 ATIC (0.52) CYP1A2CYP2C9SENP2SUMO2SUMO1
SCHEMBL3714723 0.81 ATIC (0.52) CYP1A2CYP2C9SENP2SUMO2SUMO1
SCHEMBL10393442 0.78 SENP2 (0.77) CYP1A2CYP2C9SENP2SUMO2SUMO1
SCHEMBL13239164 0.78 SENP2 (0.66) CYP1A2SENP2SUMO2SUMO1SENP7
SCHEMBL19235027 0.77 SENP2 (0.57) CYP1A2CYP2C9SENP2SUMO2SUMO1
SCHEMBL9612273 0.77 POLB (0.68) CYP1A2CYP2C9PHLPP2POLBCYP2D6

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
US-20160326384-A1 HIGH FIXATION INK COMPOSITION FOR DIGITAL TEXTILE PRINTING EVERLIGHT CHEMICAL INDUSTRIAL CORPORATION (TW) 2016-11-10 — — US disclosed
EP-3091056-A1 HIGH FIXATION INK COMPOSITION FOR DIGITAL TEXTILE PRINTING Everlight Chemical Industrial Corporation (TW) 2016-11-09 — — EP disclosed
EP-2080833-A2 Method of printing cellulosic fibre materials without an additional fixing process step Huntsman Advanced Materials (Switzerland) GmbH (CH) 2009-07-22 — — EP disclosed
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