SCHEMBL11502899

SCHEMBL11502899

Nc1ccc2cc(S(=O)(=O)O)cc(O)c2c1N=Nc1ccccc1C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 3/20 0.55
▸ CYP1A2 P05177 4/20 0.54
▸ PTPN11 Q06124 1/20 0.53
▸ SUMO2 P61956 3/20 0.51
▸ SUMO1 P63165 3/20 0.51
▸ SENP7 Q9BQF6 3/20 0.51
▸ SENP2 Q9HC62 3/20 0.51
▸ APEX1 P27695 2/20 0.50
▸ ALDH1A1 P00352 3/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ CYP2C9 P11712 3/20 0.46
▸ DNASE1L3 Q13609 1/20 0.46
▸ HIF1A Q16665 3/20 0.44
▸ CYP2C19 P33261 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ TSHR P16473 1/20 0.44
▸ PTPRA P18433 1/20 0.44
▸ PTPRB P23467 1/20 0.44
▸ RAPGEF4 Q8WZA2 1/20 0.44
▸ NT5E P21589 2/20 0.43

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
SCHEMBL11502898 1.00 ENPP2 (0.55) ENPP2CYP1A2PTPN11SUMO2SUMO1
SCHEMBL29625848 0.90 APEX1 (0.64) ENPP2CYP1A2PTPN11SUMO2SUMO1
SCHEMBL15113041 0.87 ENPP2 (0.52) ENPP2CYP1A2PTPN11SUMO2SUMO1
SCHEMBL12387833 0.87 ENPP2 (0.55) ENPP2CYP1A2PTPN11SUMO2SUMO1
SCHEMBL11226638 0.84 ENPP2 (0.67) ENPP2CYP1A2SUMO2SUMO1SENP7
SCHEMBL11226640 0.84 ENPP2 (0.67) ENPP2CYP1A2SUMO2SUMO1SENP7
SCHEMBL8067148 0.84 PTPN11 (0.54) ENPP2CYP1A2PTPN11APEX1ALDH1A1
SCHEMBL8067147 0.84 PTPN11 (0.54) ENPP2CYP1A2PTPN11APEX1ALDH1A1
SCHEMBL14133924 0.82 MEN1 (0.44) ENPP2CYP1A2PTPN11SUMO2SUMO1
SCHEMBL16490261 0.81 ENPP2 (0.60) ENPP2CYP1A2SUMO2SUMO1SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080280052-A1 Process for Printing Textile Fibre Materials in Accordance with the Ink-Jet Printing Process HUNTSMAN INTERNATIONAL LLC 2008-11-13 — — US disclosed
US-20080280052-A1 Process for Printing Textile Fibre Materials in Accordance with the Ink-Jet Printing Process HUNTSMAN INTERNATIONAL LLC 2008-11-13 — — US disclosed
US-20070226919-A1 Method for Dyeing or Printing Textile Materials HUNTSMAN INTERNATIONAL LLC (US) 2007-10-04 — — US disclosed
US-20070226919-A1 Method for Dyeing or Printing Textile Materials HUNTSMAN INTERNATIONAL LLC (US) 2007-10-04 — — US disclosed
US-4146363-A Dyeing synthetic polyamides BAYER AKTIENGESELLSCHAFT (DE) 1979-03-27 — — US disclosed
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