SCHEMBL6008284

SCHEMBL6008284

CCCc1cccc2[nH]c3cccc(C)c3c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.43
BCHE P06276 2/20 0.38
ACHE P22303 2/20 0.38
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
GABRB2 P47870 1/20 0.37
GABRA4 P48169 1/20 0.37
GABRE P78334 1/20 0.37
GABRA6 Q16445 1/20 0.37
GABRG1 Q8N1C3 1/20 0.37
GABRG3 Q99928 1/20 0.37
GABRQ Q9UN88 1/20 0.37
TSHR P16473 1/20 0.36

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
SCHEMBL6008274 0.91 BCHE (0.43) BCHEACHEDAOMEN1POLB
SCHEMBL6007824 0.85 MEN1 (0.48) GPR84BCHEACHEGABRPGABRD
SCHEMBL6008331 0.80 GPR84 (0.48) GPR84ACHEGABRPGABRDGABRA1
SCHEMBL30715250 0.80 GPR84 (0.48) GPR84ACHEGABRPGABRDGABRA1
SCHEMBL29475607 0.79 BCHE (0.58) BCHEACHEGABRPGABRDGABRA1
SCHEMBL6009655 0.79 BCHE (0.58) BCHEACHEGABRPGABRDGABRA1
SCHEMBL7823035 0.77 HTR2A (0.41) GPR84TSHR
SCHEMBL13715392 0.75 GPR84 (0.71) GPR84
SCHEMBL6009050 0.74 MAPT (0.54) BCHEACHEGABRA1GABRB2DAO
SCHEMBL28271574 0.74 GRIN1 (0.37) MEN1MAPTKMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060183022-A1 Electrochemical cell NEC TOKIN CORORATION (JP) 2006-08-17 US disclosed