SCHEMBL7244247

SCHEMBL7244247

Oc1sc2ccc(OCc3cccnc3)cc2c1Sc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F9 P00740 1/20 0.46
F10 P00742 1/20 0.46
MAPK1 P28482 2/20 0.44
GPR132 Q9UNW8 7/20 0.41
CMKLR2 P46091 1/20 0.41
CMKLR1 Q99788 1/20 0.41
CSF1R P07333 1/20 0.40
FGFR4 P22455 1/20 0.40
EDNRA P25101 1/20 0.39
MAOA P21397 1/20 0.39
DYRK1A Q13627 1/20 0.39
KIF20A O95235 1/20 0.38
ALOX5 P09917 1/20 0.38
ALOX5AP P20292 1/20 0.38
IKBKB O14920 1/20 0.38

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
SCHEMBL8023719 0.79 F9 (0.48) F9F10MAPK1GPR132CMKLR2
SCHEMBL8024562 0.75 MMP13 (0.46) F9F10MAOADYRK1A
SCHEMBL8021621 0.69 HPGD (0.48) F9F10GPR132FGFR4EDNRA
SCHEMBL3156910 0.68 ALOX5 (0.58) EDNRAMAOAALOX5
SCHEMBL7311175 0.68 MAPK1 (0.65) MAPK1GPR132CMKLR2CMKLR1IKBKB
SCHEMBL28048524 0.68 MAPK1 (0.64) F9F10MAPK1GPR132MAOA
SCHEMBL28244529 0.67 ALOX5 (0.67) F9F10MAPK1MAOADYRK1A
SCHEMBL22964344 0.67 MAPK1 (0.58) F9F10MAPK1GPR132CMKLR2
SCHEMBL8024886 0.67 MMP13 (0.48) F9F10EDNRAMAOADYRK1A
SCHEMBL28011530 0.67 MAPK1 (0.64) F9F10MAPK1GPR132CMKLR2

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-6555555-B1 Inhibitors of interleukin-6 and/or interleukin-12; for example 4,5-dimethyl-1,1-dioxidebenzo(b)thiophene; treating various inflammatory diseases, autoimmune diseases, cancer, osteoporosis ONO PHARMACEUTICAL CO., LTD. (JP) 2003-04-29 US disclosed