SCHEMBL1714546

SCHEMBL1714546

C#CCCOS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.44
CA9 Q16790 3/20 0.44
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41
NPC1 O15118 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CA1 P00915 3/20 0.38
CA12 O43570 2/20 0.38
CA3 P07451 2/20 0.38
CA4 P22748 2/20 0.38
CA6 P23280 2/20 0.38
CA5A P35218 2/20 0.38
CA7 P43166 2/20 0.38
CA13 Q8N1Q1 2/20 0.38
CA14 Q9ULX7 2/20 0.38
CA5B Q9Y2D0 2/20 0.38
EEF2K O00418 1/20 0.38
KMT2A Q03164 4/20 0.36
MMP2 P08253 2/20 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
SCHEMBL312901 0.83 CA9 (0.44) CA2CA9ALDH1A1CYP3A4CA1
SCHEMBL576531 0.82 CA2 (0.47) CA2CA9ALDH1A1CYP3A4MAPK1
SCHEMBL13707919 0.78 MAPK1 (0.46) CA2CA9ALDH1A1CYP3A4MAPK1
SCHEMBL20690134 0.78 CA2 (0.40) CA2CA9CYP3A4MAPK1TDP1
SCHEMBL29259800 0.77 NPC1 (0.46) CA2CA9ALDH1A1CYP3A4MAPK1
SCHEMBL27670058 0.77 ALDH1A1 (0.45) CA2CA9ALDH1A1CYP3A4MAPK1
SCHEMBL6115151 0.75 ALDH1A1 (0.52) CA2CA9ALDH1A1CYP3A4MAPK1
SCHEMBL28798399 0.75 GAA (0.44) CA2CA9ALDH1A1CYP3A4MAPK1
SCHEMBL23611478 0.74 ALDH1A1 (0.43) CA2CA9ALDH1A1CYP3A4CA1
SCHEMBL17302747 0.74 ALDH1A1 (0.43) CA2CA9ALDH1A1CYP3A4CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8034960-B2 Process for the synthesis C-2, C-3 substituted N-alkylated indoles useful as cPLA2 inhibitors PFIZER INC. (US) 2011-10-11 US disclosed
US-8034960-B2 Process for the synthesis C-2, C-3 substituted N-alkylated indoles useful as cPLA2 inhibitors PFIZER INC. (US) 2011-10-11 US disclosed
US-8034960-B2 Process for the synthesis C-2, C-3 substituted N-alkylated indoles useful as cPLA2 inhibitors PFIZER INC. (US) 2011-10-11 US disclosed
EP-1778629-B1 PROCESS FOR THE SYNTHESIS C-2, C-3 SUBSTITUTED N-ALKYLATED INDOLES USEFUL AS CPLA2 INHIBITORS WYETH LLC (US) 2011-07-20 EP disclosed
US-20110054189-A1 Process For The Synthesis C-2, C-3 Substituted N-Alkylated Indoles Useful As CPLA2 Inhibitors WYETH LLC 2011-03-03 US disclosed
US-20110054189-A1 Process For The Synthesis C-2, C-3 Substituted N-Alkylated Indoles Useful As CPLA2 Inhibitors WYETH LLC 2011-03-03 US disclosed
US-20110054189-A1 Process For The Synthesis C-2, C-3 Substituted N-Alkylated Indoles Useful As CPLA2 Inhibitors WYETH LLC 2011-03-03 US disclosed
US-7842837-B2 Process for the synthesis of C-2, C-3 substituted N-alkylated indoles useful as cPLA2 inhibitors WYETH LLC (US) 2010-11-30 US disclosed
US-7842837-B2 Process for the synthesis of C-2, C-3 substituted N-alkylated indoles useful as cPLA2 inhibitors WYETH LLC (US) 2010-11-30 US disclosed
US-7842837-B2 Process for the synthesis of C-2, C-3 substituted N-alkylated indoles useful as cPLA2 inhibitors WYETH LLC (US) 2010-11-30 US disclosed
US-20090306428-A1 Process for the Synthesis of C-2, C-3 Substituted N-Alkylated Indoles Useful as cPLA2 Inhibitors WYETH LLC 2009-12-10 US disclosed
US-20090306428-A1 Process for the Synthesis of C-2, C-3 Substituted N-Alkylated Indoles Useful as cPLA2 Inhibitors WYETH LLC 2009-12-10 US disclosed
US-20090306428-A1 Process for the Synthesis of C-2, C-3 Substituted N-Alkylated Indoles Useful as cPLA2 Inhibitors WYETH LLC 2009-12-10 US disclosed
US-7582772-B2 Process for the synthesis C-2, C-3 substituted N-alkylated indoles useful as CPLA2 inhibitors WYETH (US) 2009-09-01 US disclosed
US-7582772-B2 Process for the synthesis C-2, C-3 substituted N-alkylated indoles useful as CPLA2 inhibitors WYETH (US) 2009-09-01 US disclosed
US-7582772-B2 Process for the synthesis C-2, C-3 substituted N-alkylated indoles useful as CPLA2 inhibitors WYETH (US) 2009-09-01 US disclosed
EP-1778629-A1 PROCESS FOR THE SYNTHESIS C-2, C-3 SUBSTITUTED N-ALKYLATED INDOLES USEFUL AS CPLA2 INHIBITORS Wyeth (US) 2007-05-02 EP disclosed
WO-2006023611-A1 PROCESS FOR THE SYNTHESIS C-2, C-3 SUBSTITUTED N-ALKYLATED INDOLES USEFUL AS CPLA2 INHIBITORS WYETH (US) 2006-03-02 WO disclosed
US-20060041005-A1 Process for the synthesis C-2, C-3 substituted N-alkylated indoles useful as CPLA2 inhibitors WYETH (US) 2006-02-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060041005-A1 Process for the synthesis C-2, C-3 substituted N-alkylated indoles useful as CPLA2 inhibitors PLA2G4A, PLA2R1, PLA2G12A CA2 445/4885CA9 2392/4885ALDH1A1 1763/4885
US-20110054189-A1 Process For The Synthesis C-2, C-3 Substituted N-Alkylated Indoles Useful As CPLA2 Inhibitors PLA2G4A, PLA2G4B, PLA2G1B CA2 325/4885CA9 2227/4885ALDH1A1 2632/4885
US-20090306428-A1 Process for the Synthesis of C-2, C-3 Substituted N-Alkylated Indoles Useful as cPLA2 Inhibitors PLA2G4A, PLA2G12A, PLA2R1 CA2 416/4885CA9 2561/4885ALDH1A1 1722/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.