SCHEMBL11050237

SCHEMBL11050237

N#CNc1ccccc1NC#N

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.36
KDM4E B2RXH2 3/20 0.35
HSD17B10 Q99714 2/20 0.35
HPGD P15428 1/20 0.35
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
FLT1 P17948 1/20 0.31
FLT4 P35916 1/20 0.31
KDR P35968 1/20 0.31
MAPK1 P28482 1/20 0.30

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
SCHEMBL27884179 0.82 KDM4E (0.52) TSHRKDM4EHSD17B10HPGDGAA
SCHEMBL9463502 0.82 RAB9A (0.41) KDM4EHSD17B10HPGDGAAL3MBTL1
SCHEMBL2197479 0.82 GAA (0.46) KDM4EHSD17B10HPGDGAAL3MBTL1
SCHEMBL3184890 0.82 RAB9A (0.45) GAA
SCHEMBL6584880 0.82 SIGMAR1 (0.36) TSHRKDM4EHSD17B10HPGD
SCHEMBL8872909 0.82 MAPT (0.48) TSHRKDM4EHSD17B10HPGDGAA
SCHEMBL3168133 0.82 ALDH1A1 (0.43) TSHRKDM4EHSD17B10HPGDL3MBTL1
SCHEMBL8985146 0.80 KDM4E (0.41) TSHRKDM4EHSD17B10HPGDGAA
SCHEMBL10880350 0.80 RAB9A (0.37) KDM4EGAAL3MBTL1
SCHEMBL3182943 0.78 L3MBTL1 (0.50) TSHRHPGDL3MBTL1HSP90AA1HSP90AB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4486583-A MOLDING MATERIALS, COATINGS HITACHI, LTD. (JP) 1984-12-04 US claimed
US-4150051-A N-Cyanosulfonamide compounds CIBA-GEIGY CORPORATION (US) 1979-04-17 US disclosed
US-4080483-A COATINGS, MOLDING MATERIALS, LAMINATION CIBA-GEIGY CORPORATION (US) 1978-03-21 US disclosed
US-4075185-A ADDITION POLYMERIZATION CIBA-GEIGY CORPORATION (US) 1978-02-21 US disclosed
US-4049711-A POLYSULFONAMIDE MONOMERS CIBA-GEIGY CORPORATION (US) 1977-09-20 US disclosed
US-3944526-A N-cyanosulfonamide resins and intermediates therefor and products thereof CIBA-GEIGY CORPORATION (US) 1976-03-16 US disclosed