SCHEMBL5686279

SCHEMBL5686279

CN1CCN(CCCOc2ccc(Nc3ncc(C(=O)Nc4c(Cl)cccc4Cl)cn3)cc2F)CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 2/20 0.50
JAK3 P52333 2/20 0.48
BTK Q06187 2/20 0.48
KDR P35968 7/20 0.46
LCK P06239 2/20 0.46
MAPK14 Q16539 2/20 0.46
SRC P12931 1/20 0.46
TNK2 Q07912 1/20 0.46
AXL P30530 1/20 0.46
MET P08581 5/20 0.46
EGFR P00533 4/20 0.46
ERBB2 P04626 1/20 0.45

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
SCHEMBL5689288 0.93 CSF1R (0.48) CSF1RJAK3BTKKDRLCK
SCHEMBL5686060 0.93 KDR (0.54) CSF1RJAK3BTKKDRLCK
SCHEMBL4496504 0.91 KDR (0.52) CSF1RJAK3BTKKDRLCK
SCHEMBL4503003 0.89 MET (0.45) CSF1RJAK3BTKKDRLCK
SCHEMBL5689079 0.88 KDR (0.47) CSF1RKDRLCKMAPK14SRC
SCHEMBL4497531 0.88 KDR (0.47) CSF1RKDRLCKMAPK14SRC
SCHEMBL4481044 0.87 EGFR (0.47) JAK3BTKKDRLCKMAPK14
SCHEMBL5686145 0.85 TNK2 (0.50) JAK3BTKKDRLCKMAPK14
SCHEMBL4493427 0.84 CSF1R (0.47) CSF1RJAK3BTKKDRLCK
SCHEMBL4496395 0.84 TNK2 (0.56) JAK3BTKKDRLCKMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1648464-A1 2-AMINO-4-HYDROXY-5-PYRIMIDINCARBOXAMID DERIVATIVES AND RELATED COMPOUNDS AS T-CELL ACTIVATION INHIBITORS FOR THE TREATMENT OF INFLAMMATIONS AMGEN INC. (US) 2006-04-26 EP disclosed
WO-2005009443-A1 2-AMINO-4-HYDROXY-5-PYRIMIDINECARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF T CELL ACTIVATION FOR THE TREATMENT OF INFLAMMATORY DISEASES AMGEN INC. (US) 2005-02-03 WO disclosed