SCHEMBL6619641

SCHEMBL6619641

CSc1ncc2c(n1)N(C(C)C)C(=O)N(c1c(Cl)cccc1Cl)C2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR4 P22455 3/20 0.45
MAPK14 Q16539 2/20 0.39
LCK P06239 1/20 0.39
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
RPS6KA5 O75582 1/20 0.35
SIK2 Q9H0K1 2/20 0.34
CSF1R P07333 1/20 0.34
SIK1 P57059 1/20 0.34
SIK3 Q9Y2K2 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
THRB P10828 1/20 0.33
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
PIM1 P11309 1/20 0.31
TTK P33981 1/20 0.31
PIM2 Q9P1W9 1/20 0.31

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
SCHEMBL5229018 0.85 FGFR4 (0.61) FGFR4MAPK14LCKMAPTKDM4E
SCHEMBL6619725 0.82 FGFR4 (0.47) FGFR4MAPK14LCKMAPTKDM4E
SCHEMBL6619372 0.82 FGFR4 (0.42) FGFR4MAPK14LCKMAPTLMNA
SCHEMBL30955653 0.78 FGFR4 (0.50) FGFR4MEN1KMT2APIM1TTK
SCHEMBL24170655 0.78 FGFR4 (0.47) FGFR4MEN1KMT2APIM1TTK
SCHEMBL30955695 0.76 FGFR4 (0.45) FGFR4PIM1TTKPIM2
SCHEMBL6618748 0.75 MAPK14 (0.44) FGFR4MAPK14LCKMAPTKDM4E
SCHEMBL1522002 0.75 FGFR4 (0.49) FGFR4MEN1KMT2APIM1TTK
SCHEMBL6620383 0.75 FGFR4 (0.43) FGFR4MAPK14LCKSIK2CSF1R
SCHEMBL30955707 0.74 FGFR4 (0.44) FGFR4PIM1TTKPIM2

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