SCHEMBL8889438

SCHEMBL8889438

O=C(O)c1ccc(-c2ccc3ncc(-c4cccc(F)c4)cc3c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.55
PDGFRA P16234 2/20 0.55
MAP4K4 O95819 4/20 0.50
CHEK2 O96017 1/20 0.50
CSNK1G2 P78368 1/20 0.48
CLK4 Q9HAZ1 1/20 0.48
MKNK2 Q9HBH9 1/20 0.48
MAP4K5 Q9Y4K4 1/20 0.48
CSNK2A2 P19784 1/20 0.47
CSNK2B P67870 1/20 0.47
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
BCL2L1 Q07817 1/20 0.46
BAD Q92934 1/20 0.46
HPGDS O60760 1/20 0.46
KMO O15229 1/20 0.46
TNIK Q9UKE5 1/20 0.46
TRPM8 Q7Z2W7 1/20 0.46
DHODH Q02127 2/20 0.45
TRIM24 O15164 1/20 0.44

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
SCHEMBL8499693 0.93 PDGFRB (0.52) PDGFRBPDGFRAMAP4K4CHEK2CSNK1G2
Hydrochloric Acid SCHEMBL8891443 0.90 PDGFRB (0.53) PDGFRBPDGFRAMAP4K4CHEK2CSNK1G2
SCHEMBL8502256 0.85 CSNK2A2 (0.54) PDGFRBPDGFRAMAP4K4CHEK2CSNK1G2
SCHEMBL30189289 0.84 BCL2L1 (0.64) RXRARXRBBCL2L1BADKMO
SCHEMBL505269 0.84 BCL2L1 (0.64) RXRARXRBBCL2L1BADKMO
SCHEMBL4123055 0.83 MGAM (0.58) PDGFRBPDGFRAMAP4K4CSNK1G2CLK4
SCHEMBL8503239 0.82 DHODH (0.49) PDGFRBPDGFRAMAP4K4CHEK2CSNK1G2
SCHEMBL8502253 0.82 PDGFRB (0.64) PDGFRBPDGFRAMAP4K4CSNK1G2CLK4
SCHEMBL8887276 0.81 CHEK2 (0.53) MAP4K4CHEK2CSNK2A2CSNK2BHPGDS
SCHEMBL8503378 0.81 PDGFRB (0.57) PDGFRBPDGFRAMAP4K4CHEK2CSNK1G2

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
US-5646153-A INHIBITING ABNORMAL CELL PROLIFERATION RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-08 US disclosed
US-5480883-A Bis mono- and bicyclic aryl and heteroaryl compounds which inhibit EGF and/or PDGF receptor tyrosine kinase RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-01-02 US disclosed