SCHEMBL8504167

SCHEMBL8504167

CCNC(=O)CCc1ccc2ncc(-c3cccc(F)c3)cc2c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 9/20 0.47
MET P08581 1/20 0.47
ABL1 P00519 1/20 0.46
GSK3A P49840 1/20 0.45
GSK3B P49841 1/20 0.45
PDGFRB P09619 1/20 0.45
PDGFRA P16234 1/20 0.45
LMNA P02545 2/20 0.44
TP53 P04637 2/20 0.44
HCAR2 Q8TDS4 1/20 0.43
EGLN1 Q9GZT9 1/20 0.40

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
SCHEMBL8502310 0.92 CDK8 (0.47) CDK8ABL1GSK3AGSK3BPDGFRB
SCHEMBL8499494 0.87 THRB (0.51) CDK8LMNATP53HCAR2
SCHEMBL8499164 0.85 PDGFRB (0.52) CDK8METGSK3AGSK3BPDGFRB
SCHEMBL8501202 0.84 FFAR1 (0.51) CDK8METPDGFRBPDGFRAHCAR2
SCHEMBL8502612 0.80 CDK8 (0.58) CDK8ABL1PDGFRBPDGFRALMNA
SCHEMBL8499069 0.80 GSK3A (0.48) CDK8ABL1GSK3AGSK3BPDGFRB
SCHEMBL8502204 0.78 THRB (0.51) CDK8LMNATP53HCAR2
Hydrochloric Acid SCHEMBL8501955 0.77 PDGFRB (0.49) METPDGFRBPDGFRA
SCHEMBL8499905 0.76 PDGFRB (0.52) CDK8GSK3AGSK3BPDGFRBPDGFRA
SCHEMBL8889522 0.75 PDGFRB (0.47) METPDGFRBPDGFRA

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 5 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 claimed
US-RE36256-E ADMINISTERING ARYL-SUBSTITUTED QUINOXALINE DERIVATIVES AS ANTIPROLIFERATIVE, ANTICARCINOGENIC AND ANTITUMOR AGENTS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-07-20 US disclosed
US-5795889-A INHIBITING CELL GROWTH WITH ENZYME INHIBITORS FOR SKIN DISORDERS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-08-18 US disclosed
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