SCHEMBL6682709

SCHEMBL6682709

CCCPc1ccccc1CC

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.38
GABRB2 P47870 4/20 0.38
MGLL Q99685 1/20 0.35
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
CYP2D6 P10635 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
CTSB P07858 1/20 0.31

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
SCHEMBL3388879 0.91 GABRA1 (0.41) GABRA1GABRB2MGLLMAPTNPSR1
SCHEMBL9493735 0.87 GABRA1 (0.38) GABRA1GABRB2MGLLMAPTNPSR1
SCHEMBL7902242 0.84 TP53 (0.33) TP53
SCHEMBL28241024 0.83 PNMT (0.39)
SCHEMBL28326917 0.82 GABRA1 (0.41) GABRA1GABRB2MGLLMAPTNPSR1
SCHEMBL7560515 0.82 GABRA1 (0.41) GABRA1GABRB2MGLLMAPTNPSR1
SCHEMBL28240930 0.82 LIPG (0.42) CYP2D6
SCHEMBL1423121 0.77 GABRA1 (0.44) GABRA1GABRB2MGLLMAPTNPSR1
SCHEMBL7558656 0.76 ACHE (0.39) MAPTALDH1A1
Hydrochloric Acid SCHEMBL2154393 0.75 GABRA1 (0.42) GABRA1GABRB2MGLLMAPTNPSR1

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
EP-0774514-B1 A method for quantitatively determining creatine kinase and a reagent therefor KYOWA MEDEX CO LTD (JP) 2000-03-08 EP claimed
EP-0926244-B1 METHODS AND REAGENTS FOR QUANTITATIVELY DETERMINING ASCORBIC ACID KYOWA MEDEX CO LTD (JP) 2004-11-17 EP disclosed
EP-0774514-B1 A method for quantitatively determining creatine kinase and a reagent therefor KYOWA MEDEX CO LTD (JP) 2000-03-08 EP disclosed
EP-0926244-A1 METHODS AND REAGENTS FOR QUANTITATIVELY DETERMINING ASCORBIC ACID KYOWA MEDEX CO., LTD. (JP) 1999-06-30 EP disclosed
US-5817467-A PHOSPHINE, MERCAPTAN, REACTION SUBSTRATE KYOWA MEDEX CO., LTD. (JP) 1998-10-06 US disclosed
EP-0774514-A1 A method for quantitatively determining creatine kinase and a reagent therefor KYOWA MEDEX CO., LTD. (JP) 1997-05-21 EP disclosed