SCHEMBL6008281

SCHEMBL6008281

Cc1cccc2[nH]c3cccc(Cl)c3c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.46
GAA P10253 2/20 0.45
MGAM O43451 1/20 0.45
SI P14410 1/20 0.45
MGAM2 Q2M2H8 1/20 0.45
ERCC5 P28715 1/20 0.44
FEN1 P39748 1/20 0.44
GABRP O00591 2/20 0.41
GABRD O14764 2/20 0.41
GABRA1 P14867 2/20 0.41
GABRB1 P18505 2/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
GABRA5 P31644 2/20 0.41
GABRA3 P34903 2/20 0.41
GABRA2 P47869 2/20 0.41
GABRB2 P47870 2/20 0.41
GABRA4 P48169 2/20 0.41
GABRE P78334 2/20 0.41
GABRA6 Q16445 2/20 0.41

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
SCHEMBL30715250 0.89 GPR84 (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6008331 0.89 GPR84 (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL31619545 0.86 ERCC5 (0.53) CHEK1GAAERCC5FEN1GABRP
SCHEMBL6009055 0.86 ERCC5 (0.53) CHEK1GAAERCC5FEN1GABRP
SCHEMBL20276479 0.81 ERCC5 (0.50) CHEK1GAAERCC5FEN1GABRP
SCHEMBL6009679 0.77 IMPDH2 (0.57) GAAMGAMSIMGAM2GABRP
SCHEMBL6008267 0.77 ALDH1A1 (0.44) FEN1GABRPGABRDGABRA1GABRB1
SCHEMBL6008305 0.77 GABRP (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL31607507 0.76 TNKS2 (0.52) CHEK1DYRK1AGRIA1CACNG8
SCHEMBL7832298 0.75 ALDH1A1 (0.43) GAAMGAMSIMGAM2PARP1

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