SCHEMBL13764102

SCHEMBL13764102

Cc1ccc2c(O)c(N=Nc3cc(S(=O)(=O)O)ccc3C(=O)O)c(S(=O)(=O)O)cc2c1S(=O)(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 9/20 0.46
▸ ALDH1A1 P00352 3/20 0.45
▸ HIF1A Q16665 2/20 0.45
▸ PTPN11 Q06124 1/20 0.43
▸ PHLPP2 Q6ZVD8 1/20 0.42
▸ PRMT1 Q99873 1/20 0.41
▸ CD40 P25942 1/20 0.41
▸ CD40LG P29965 1/20 0.41
▸ CYP1A2 P05177 3/20 0.41
▸ CYP2C9 P11712 1/20 0.40
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ SUMO2 P61956 1/20 0.39
▸ SUMO1 P63165 1/20 0.39
▸ SENP7 Q9BQF6 1/20 0.39
▸ SENP3 Q9H4L4 1/20 0.39
▸ SENP2 Q9HC62 1/20 0.39
▸ SENP1 Q9P0U3 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL13763509 0.80 CD40 (0.60) ENPP2ALDH1A1HIF1APHLPP2CD40
SCHEMBL9136748 0.78 CD40 (0.57) ENPP2ALDH1A1HIF1APHLPP2PRMT1
SCHEMBL13744722 0.78 MPL (0.40) ENPP2ALDH1A1HIF1APHLPP2PRMT1
SCHEMBL12028000 0.77 ENPP2 (0.49) ENPP2ALDH1A1HIF1APTPN11PHLPP2
SCHEMBL14026060 0.77 CD40 (0.60) ENPP2ALDH1A1HIF1APTPN11PHLPP2
SCHEMBL12028027 0.77 ALDH1A1 (0.49) ENPP2ALDH1A1HIF1APTPN11PHLPP2
SCHEMBL14400893 0.75 CYP1A2 (0.42) ENPP2ALDH1A1HIF1APTPN11PHLPP2
SCHEMBL13763561 0.75 PHLPP2 (0.42) ENPP2ALDH1A1HIF1APHLPP2CD40
SCHEMBL8972554 0.74 CYP1A2 (0.48) ENPP2ALDH1A1HIF1APHLPP2PRMT1
SCHEMBL10488468 0.74 ENPP2 (0.51) ENPP2ALDH1A1HIF1APHLPP2CD40

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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