SCHEMBL8634018

SCHEMBL8634018

CCCCCCc1ccc(-c2ccccc2)c(-c2ccccc2)c1C#N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.43
KDM4E B2RXH2 3/20 0.39
GCGR P47871 2/20 0.39
HSD17B10 Q99714 3/20 0.39
TSHR P16473 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPK1 P28482 1/20 0.38
ELANE P08246 1/20 0.37
CTSG P08311 1/20 0.37
HPGD P15428 2/20 0.37
ADRA2A P08913 1/20 0.37
ADORA2A P29274 1/20 0.37
HTT P42858 1/20 0.37
SQOR Q9Y6N5 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GPR3 P46089 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
SCHEMBL1640242 0.99 DHFR (0.41) DHFRKDM4EGCGRHSD17B10TSHR
SCHEMBL1641624 0.83 TSHR (0.44) KDM4EHSD17B10TSHRLIPGALDH1A1
SCHEMBL15063661 0.83 TSHR (0.44) KDM4EHSD17B10TSHRLIPGALDH1A1
SCHEMBL11292965 0.83 TSHR (0.44) KDM4EHSD17B10TSHRLIPGALDH1A1
SCHEMBL9620444 0.83 TSHR (0.44) KDM4EHSD17B10TSHRLIPGALDH1A1
SCHEMBL317340 0.83 TSHR (0.44) KDM4EHSD17B10TSHRLIPGALDH1A1
SCHEMBL28521138 0.82 DHFR (0.49) DHFRGCGRTSHRLIPGELANE
SCHEMBL365486 0.81 CD274 (0.44) KDM4EHSD17B10TSHRLIPGALDH1A1
SCHEMBL11303166 0.80 GRIA4 (0.43)
SCHEMBL5309215 0.78 TSHR (0.49) KDM4EHSD17B10TSHRLIPGALDH1A1

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
US-5712066-A ELECTROGRAPHY, CHANGE IN BIREFRINGENCE, LIQUID CRYSTALS, PHOTOSTABILITY CANON KABUSHIKI KAISHA (JP) 1998-01-27 US disclosed
EP-0464784-B1 Image forming method, recording medium, and visible image reproducing method CANON KK (JP) 1996-03-27 EP disclosed
EP-0464784-A2 Image forming method, recording medium, and visible image reproducing method CANON KABUSHIKI KAISHA (JP) 1992-01-08 EP disclosed