SCHEMBL6619490

SCHEMBL6619490

CCN1C(=O)N(c2c(Cl)cccc2Cl)Cc2cnc(S(C)(=O)=O)nc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.42
LCK P06239 1/20 0.42
FGFR4 P22455 9/20 0.40
FGFR1 P11362 4/20 0.36
FGFR2 P21802 2/20 0.36
FGFR3 P22607 1/20 0.36
TP53 P04637 4/20 0.35
MAPT P10636 3/20 0.35
NPC1 O15118 3/20 0.35
TLR9 Q9NR96 3/20 0.35
THRB P10828 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 1/20 0.34
XBP1 P17861 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 1/20 0.34
USP2 O75604 1/20 0.34

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
SCHEMBL6618524 0.89 FGFR4 (0.44) MAPK14LCKFGFR4FGFR1FGFR2
SCHEMBL5231241 0.86 FGFR4 (0.52) MAPK14LCKFGFR4FGFR1FGFR2
SCHEMBL6620496 0.85 FGFR4 (0.39) MAPK14LCKFGFR4FGFR1FGFR2
SCHEMBL6619372 0.83 FGFR4 (0.42) MAPK14LCKFGFR4FGFR1FGFR2
SCHEMBL6619216 0.82 MAPK14 (0.42) MAPK14LCKFGFR4TP53MAPT
SCHEMBL6619197 0.80 FGFR4 (0.47) MAPK14LCKFGFR4FGFR1FGFR3
SCHEMBL6619217 0.77 FGFR4 (0.36) MAPK14LCKFGFR4TP53MAPT
SCHEMBL6622980 0.76 MAPK14 (0.43) MAPK14LCKFGFR4TP53MAPT
SCHEMBL6622657 0.75 FGFR4 (0.42) MAPK14LCKFGFR4FGFR1FGFR2
SCHEMBL6619391 0.75 MAPK14 (0.37) MAPK14LCKFGFR4TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1123295-B1 BICYCLIC NITROGEN HETEROCYCLES HOFFMANN LA ROCHE (CH) 2004-09-29 EP disclosed
EP-1123295-A1 BICYCLIC NITROGEN HETEROCYCLES F. HOFFMANN-LA ROCHE AG (CH) 2001-08-16 EP disclosed
US-6150373-A AMINO-SUBSTITUTED DIHYDROPYRIMIDO(4,5-D)PYRIMIDINONE DERIVATIVES; INHIBITORS OF THE T-CELL TYROSINE KINASE P56LCK; IMMUNOSUPPRESSANTS; ANTIINFLAMMATORY/-CARCINOGENIC AGENTS; BRONCHOPULMONARY, DERMATOLOGICAL AND CARDIOVASCULAR DISORDERS HOFFMANN-LA ROCHE INC. (US) 2000-11-21 US disclosed
WO-2000024744-A1 BICYCLIC NITROGEN HETEROCYCLES F. HOFFMANN-LA ROCHE AG (CH) 2000-05-04 WO disclosed