SCHEMBL4789095

SCHEMBL4789095

CCN(CC)CCNC(=O)c1c(C)[nH]c(C=O)c1-c1ccccc1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.54
PDGFRB P09619 8/20 0.54
PRKAA1 Q13131 8/20 0.54
PRKAA2 P54646 6/20 0.54
FGFR1 P11362 5/20 0.54
LMNA P02545 3/20 0.47
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 2/20 0.47
HTT P42858 2/20 0.47
KMT2A Q03164 2/20 0.47
MITF O75030 1/20 0.47
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPK1 P28482 1/20 0.47
HSD17B10 Q99714 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
EGFR P00533 6/20 0.47
CSF1R P07333 3/20 0.47
FLT3 P36888 3/20 0.47

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
SCHEMBL4789092 0.81 KDR (0.75) KDRPDGFRBPRKAA1PRKAA2FGFR1
SCHEMBL4789091 0.81 KDR (0.75) KDRPDGFRBPRKAA1PRKAA2FGFR1
SCHEMBL4934488 0.78 KDR (0.73) KDRPDGFRBPRKAA1PRKAA2FGFR1
SCHEMBL4934493 0.78 KDR (0.73) KDRPDGFRBPRKAA1PRKAA2FGFR1
SCHEMBL4884843 0.78 KDR (0.70) KDRPDGFRBPRKAA1PRKAA2FGFR1
SCHEMBL4884833 0.78 KDR (0.70) KDRPDGFRBPRKAA1PRKAA2FGFR1
SCHEMBL4817673 0.77 SMN1; SMN2 (0.56) PDGFRBFGFR1LMNAALDH1A1MEN1
SCHEMBL4750921 0.77 ALDH1A1 (0.54) LMNAALDH1A1MEN1HTTKMT2A
SCHEMBL1044420 0.75 KDR (0.59) KDRPDGFRBPRKAA1PRKAA2FGFR1
SCHEMBL4813941 0.72 KDR (0.78) KDRPDGFRBPRKAA1PRKAA2FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008145398-A1 4-ARYLPYRROLE SUBSTITUTED 2-INDOLINE DERIVATIVES ACTIVE AS PROTEIN KINASE INHIBITORS PFIZER ITALIA S.R.L. (IT) 2008-12-04 WO disclosed