SCHEMBL6635845

SCHEMBL6635845

CCC(=O)N/N=C\c1ccccc1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 0.68
DUSP3 P51452 1/20 0.68
PTPN5 P54829 1/20 0.68
PTPN11 Q06124 1/20 0.68
KDM4E B2RXH2 12/20 0.63
KMT2A Q03164 5/20 0.63
MEN1 O00255 3/20 0.63
NPC1 O15118 2/20 0.63
HTT P42858 5/20 0.60
GAA P10253 5/20 0.60
TDP1 Q9NUW8 3/20 0.60
TP53 P04637 1/20 0.60
CYP3A4 P08684 1/20 0.60
CYP2D6 P10635 1/20 0.60
HPGD P15428 1/20 0.60
MAPK1 P28482 1/20 0.60
HSD17B10 Q99714 1/20 0.60
MAPT P10636 3/20 0.59
LMNA P02545 2/20 0.59
NCOA1 Q15788 1/20 0.58

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
SCHEMBL15127235 1.00 CTRC (0.68) CTRCDUSP3PTPN5PTPN11KDM4E
SCHEMBL6635848 1.00 CTRC (0.68) CTRCDUSP3PTPN5PTPN11KDM4E
SCHEMBL2964189 0.85 CTRC (0.74) CTRCDUSP3PTPN5PTPN11KDM4E
SCHEMBL2964190 0.85 CTRC (0.74) CTRCDUSP3PTPN5PTPN11KDM4E
SCHEMBL31035857 0.85 CTRC (0.74) CTRCDUSP3PTPN5PTPN11KDM4E
SCHEMBL15275529 0.84 KDM4E (0.76) CTRCDUSP3PTPN5PTPN11KDM4E
SCHEMBL18850756 0.84 CTRC (0.68) CTRCDUSP3PTPN5PTPN11KDM4E
SCHEMBL16141587 0.83 CTRC (0.62) CTRCDUSP3PTPN5PTPN11KDM4E
SCHEMBL9967755 0.83 CTRC (0.62) CTRCDUSP3PTPN5PTPN11KDM4E
SCHEMBL6633349 0.83 HTT (0.70) CTRCDUSP3PTPN5PTPN11KDM4E

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-0909788-B1 RUBBER COMPOSITION AND PNEUMATIC TIRES BRIDGESTONE CORP (JP) 2004-12-01 EP disclosed
EP-1420044-A2 Rubber composition and pneumatic tire Bridgestone Corporation (JP) 2004-05-19 EP disclosed
EP-0909788-A1 RUBBER COMPOSITION AND PNEUMATIC TIRES Bridgestone Corporation (JP) 1999-04-21 EP disclosed