SCHEMBL17174187

SCHEMBL17174187

Clc1cc2ccc(-c3cccc(-c4ccc5ccc6cccnc6c5n4)c3)nc2c2ncccc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 5/20 0.68
▸ CCR8 P51685 5/20 0.68
▸ L3MBTL1 Q9Y468 3/20 0.68
▸ ALDH1A1 P00352 4/20 0.54
▸ MAPT P10636 5/20 0.43
▸ LMNA P02545 5/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ HSP90AA1 P07900 4/20 0.43
▸ TP53 P04637 3/20 0.43
▸ CYP3A4 P08684 3/20 0.43
▸ ALOX15 P16050 3/20 0.43
▸ HTT P42858 3/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ TDP1 Q9NUW8 3/20 0.43
▸ MMP14 P50281 3/20 0.43
▸ CCR5 P51681 3/20 0.43
▸ MMP9 P14780 2/20 0.43
▸ MMP13 P45452 2/20 0.43
▸ HIF1A Q16665 2/20 0.43
▸ MEN1 O00255 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
SCHEMBL17174184 0.96 L3MBTL1 (0.64) CCR1CCR8L3MBTL1ALDH1A1MAPT
SCHEMBL17146611 0.85 CCR1 (0.59) CCR1CCR8L3MBTL1MAPTLMNA
SCHEMBL17174191 0.85 CCR1 (0.59) CCR1CCR8L3MBTL1MAPTLMNA
SCHEMBL29517679 0.85 CCR1 (0.59) CCR1CCR8L3MBTL1MAPTLMNA
SCHEMBL599744 0.85 CCR1 (0.59) CCR1CCR8L3MBTL1MAPTLMNA
SCHEMBL17174194 0.85 CCR1 (0.59) CCR1CCR8L3MBTL1MAPTLMNA
SCHEMBL17174186 0.85 CCR1 (0.45) CCR1CCR8L3MBTL1ALDH1A1MAPT
SCHEMBL17174040 0.84 CCR1 (0.57) CCR1CCR8L3MBTL1MAPTLMNA
SCHEMBL10032465 0.84 CCR1 (0.57) CCR1CCR8L3MBTL1MAPTLMNA
SCHEMBL17146664 0.84 CCR1 (0.44) CCR1CCR8L3MBTL1ALDH1A1MAPT

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 4 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-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
Send feedback