SCHEMBL6619503

SCHEMBL6619503

COc1ccccc1N1Cc2cnc(S(C)(=O)=O)nc2N(C)C1=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FGFR4 P22455 8/20 0.46
BMX P51813 2/20 0.40
EGFR P00533 1/20 0.40
CSF1R P07333 1/20 0.40
FGFR1 P11362 5/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
TNK2 Q07912 1/20 0.38
MAP4K2 Q12851 1/20 0.38
FGFR2 P21802 3/20 0.36
FGFR3 P22607 3/20 0.36
KDR P35968 2/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL6622724 0.86 TNK2 (0.43) FGFR4BMXEGFRCSF1RFGFR1
SCHEMBL6070019 0.85 FGFR4 (0.40) FGFR4BMXFGFR1TNK2MAP4K2
SCHEMBL6623008 0.85 FGFR4 (0.43) FGFR4EGFRCSF1RALDH1A1
SCHEMBL30837054 0.82 FGFR4 (0.51) FGFR4EGFRFGFR1TNK2MAP4K2
SCHEMBL6620595 0.82 FGFR4 (0.51) FGFR4EGFRFGFR1TNK2MAP4K2
SCHEMBL15413275 0.81 FGFR4 (0.68) FGFR4BMXFGFR1FGFR2FGFR3
SCHEMBL15434046 0.80 FGFR4 (0.60) FGFR4FGFR1FGFR2FGFR3KDR
SCHEMBL29546170 0.80 FGFR4 (0.60) FGFR4FGFR1FGFR2FGFR3KDR
SCHEMBL6618886 0.79 FGFR4 (0.72) FGFR4BMXEGFRCSF1RFGFR1
SCHEMBL6625602 0.79 FGFR4 (0.40) FGFR4BMXEGFRCSF1RFGFR1

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