SCHEMBL17174191

SCHEMBL17174191

c1cc(-c2ccc3ccc4cccnc4c3n2)cc(-c2ccc3ccc4ccc(-c5cccc(-c6ccc7ccc8ccc(-c9cccc(-c%10ccc%11ccc%12cccnc%12c%11n%10)c9)nc8c7n6)c5)nc4c3n2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 4/20 0.59
CCR8 P51685 4/20 0.59
CCR5 P51681 3/20 0.59
LMNA P02545 3/20 0.59
MMP2 P08253 2/20 0.59
TSHR P16473 2/20 0.59
KDM4E B2RXH2 2/20 0.59
GMNN O75496 1/20 0.59
TP53 P04637 1/20 0.59
HSP90AA1 P07900 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2D6 P10635 1/20 0.59
MAPT P10636 1/20 0.59
MMP9 P14780 1/20 0.59
ALOX15 P16050 1/20 0.59
NFKB1 P19838 1/20 0.59
MMP8 P22894 1/20 0.59
THPO P40225 1/20 0.59
MTOR P42345 1/20 0.59
HTT P42858 1/20 0.59

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
SCHEMBL599744 1.00 CCR1 (0.59) CCR1CCR8CCR5LMNAMMP2
SCHEMBL17146611 1.00 CCR1 (0.59) CCR1CCR8CCR5LMNAMMP2
SCHEMBL17174194 1.00 CCR1 (0.59) CCR1CCR8CCR5LMNAMMP2
SCHEMBL29517679 1.00 CCR1 (0.59) CCR1CCR8CCR5LMNAMMP2
SCHEMBL17174040 0.98 CCR1 (0.57) CCR1CCR8CCR5LMNAMMP2
SCHEMBL10032465 0.98 CCR1 (0.57) CCR1CCR8CCR5LMNAMMP2
SCHEMBL17174038 0.95 CCR1 (0.53) CCR1CCR8CCR5LMNAMMP2
SCHEMBL17174042 0.93 CCR1 (0.52) CCR1CCR8CCR5LMNAMMP2
SCHEMBL20732549 0.93 CCR1 (0.52) CCR1CCR8CCR5LMNAMMP2
SCHEMBL29314790 0.93 CCR1 (0.52) CCR1CCR8CCR5LMNAMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9748593-B2 Polymer electrolyte composition, and polymer electrolyte membrane, membrane electrode complex and solid polymer-type fuel cell each produced using same TORAY INDUSTRIES, INC. (JP) 2017-08-29 US disclosed
US-9748593-B2 Polymer electrolyte composition, and polymer electrolyte membrane, membrane electrode complex and solid polymer-type fuel cell each produced using same TORAY INDUSTRIES, INC. (JP) 2017-08-29 US disclosed
US-20170125832-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME TORAY INDUSTRIES, INC. (JP) 2017-05-04 US disclosed
US-20170125832-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME TORAY INDUSTRIES, INC. (JP) 2017-05-04 US disclosed
US-20150295262-A1 POLYMER ELECTROLYTE COMPOSITION, AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE ELECTRODE COMPLEX AND SOLID POLYMER-TYPE FUEL CELL EACH PRODUCED USING SAME TORAY INDUSTRIES, INC. (JP) 2015-10-15 US disclosed
US-20150295262-A1 POLYMER ELECTROLYTE COMPOSITION, AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE ELECTRODE COMPLEX AND SOLID POLYMER-TYPE FUEL CELL EACH PRODUCED USING SAME TORAY INDUSTRIES, INC. (JP) 2015-10-15 US disclosed