SCHEMBL9707166

SCHEMBL9707166

CCCCCCCCCCCCCCCCc1ccc2c(c1)[nH]c1ccccc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.66
CTSV O60911 3/20 0.58
CTSL P07711 3/20 0.58
GABRP O00591 2/20 0.51
GABRD O14764 2/20 0.51
GABRA1 P14867 2/20 0.51
GABRB1 P18505 2/20 0.51
GABRG2 P18507 2/20 0.51
GABRB3 P28472 2/20 0.51
GABRA5 P31644 2/20 0.51
GABRA3 P34903 2/20 0.51
GABRA2 P47869 2/20 0.51
GABRB2 P47870 2/20 0.51
GABRA4 P48169 2/20 0.51
GABRE P78334 2/20 0.51
GABRA6 Q16445 2/20 0.51
GABRG1 Q8N1C3 2/20 0.51
GABRG3 Q99928 2/20 0.51
GABRQ Q9UN88 2/20 0.51
IDO1 P14902 1/20 0.51

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
SCHEMBL9707173 1.00 KIF11 (0.66) KIF11CTSVCTSLGABRPGABRD
SCHEMBL23837219 1.00 KIF11 (0.66) KIF11CTSVCTSLGABRPGABRD
SCHEMBL11296266 0.98 KIF11 (0.68) KIF11CTSVCTSLGABRPGABRD
SCHEMBL28521664 0.94 KIF11 (0.70) KIF11CTSVCTSLGABRPGABRD
SCHEMBL9707132 0.92 KIF11 (0.51) KIF11CTSVCTSLKDM4EALDH1A1
SCHEMBL28298246 0.92 KIF11 (0.51) KIF11CTSVCTSLKDM4EALDH1A1
SCHEMBL9707129 0.92 KIF11 (0.51) KIF11CTSVCTSLKDM4EALDH1A1
SCHEMBL9707151 0.92 KIF11 (0.51) KIF11CTSVCTSLKDM4EALDH1A1
SCHEMBL9707156 0.92 KIF11 (0.51) KIF11CTSVCTSLKDM4EALDH1A1
SCHEMBL9163470 0.91 CTSV (0.58) KIF11CTSVCTSLGABRPGABRD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0218422-B1 SEMICONDUCTOR LIGHT-EMITTING ELEMENT KABUSHIKI KAISHA TOSHIBA (JP) 1992-09-16 EP disclosed
US-4819057-A METAL-ORGANIC FILMS-SEMICONDUCTOR JUNCTION KABUSHIKI KAISHA TOSHIBA (JP) 1989-04-04 US disclosed
EP-0218422-A2 Semiconductor light-emitting element KABUSHIKI KAISHA TOSHIBA (JP) 1987-04-15 EP disclosed