SCHEMBL4190922

SCHEMBL4190922

CCOc1cc(CCl)cc(Oc2ccc(C(F)(F)F)cn2)c1.CCOc1cc(CP(=O)(OCC)OCC)cc(Oc2ccc(C(F)(F)F)cn2)c1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.55
HPGD P15428 1/20 0.44
SCN9A Q15858 14/20 0.40
LMNA P02545 1/20 0.40
SCN10A Q9Y5Y9 3/20 0.40
LIPE Q05469 1/20 0.39
THRB P10828 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
SCHEMBL1012147 0.95 MAPK1 (0.61) MAPK1HPGDSCN9ALMNASCN10A
SCHEMBL1010121 0.89 MAPK1 (0.69) MAPK1HPGDSCN9ALMNALIPE
SCHEMBL14810517 0.86 MAPK1 (0.51) MAPK1HPGDSCN9ALMNASCN10A
SCHEMBL1012278 0.85 MAPK1 (0.50) MAPK1HPGDSCN9ALMNASCN10A
SCHEMBL30677804 0.83 MAPK1 (0.64) MAPK1HPGDSCN9ASCN10ALIPE
SCHEMBL1009588 0.83 MAPK1 (0.64) MAPK1HPGDSCN9ASCN10ALIPE
SCHEMBL1011518 0.82 MAPK1 (0.47) MAPK1HPGDSCN9ALMNASCN10A
SCHEMBL1011905 0.80 MAPK1 (0.69) MAPK1HPGDSCN9ALMNALIPE
SCHEMBL14810263 0.76 MAPK1 (0.53) MAPK1HPGDSCN9ALMNASCN10A
SCHEMBL4187097 0.75 MAPK1 (0.62) MAPK1HPGDSCN9ALMNALIPE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2076508-A2 BIARYL ETHER UREA COMPOUNDS Pfizer Products Inc. (US) 2009-07-08 EP disclosed
WO-2008047229-A2 BIARYL ETHER UREA COMPOUNDS PFIZER PRODUCTS INC. (US) 2008-04-24 WO disclosed