SCHEMBL4998906

SCHEMBL4998906

CCCC1CCN(c2ccc(NC=C3C(=O)Nc4cc(F)ccc43)cc2C)CC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.40
PDGFRB P09619 6/20 0.39
KDR P35968 4/20 0.35
FGFR1 P11362 1/20 0.35
PRKAA2 P54646 1/20 0.34
PRKAA1 Q13131 1/20 0.34
MDM2 Q00987 1/20 0.33
FLT3 P36888 2/20 0.33
TNK2 Q07912 1/20 0.32
AURKB Q96GD4 2/20 0.32
NTRK1 P04629 1/20 0.32
AURKA O14965 1/20 0.32
PDGFRA P16234 1/20 0.32
AURKC Q9UQB9 1/20 0.32
ADAMTS5 Q9UNA0 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL4998904 1.00 TGM2 (0.40) TGM2PDGFRBKDRFGFR1PRKAA2
SCHEMBL4994171 0.93 KDR (0.42) PDGFRBKDRFGFR1FLT3NTRK1
SCHEMBL4994164 0.93 KDR (0.42) PDGFRBKDRFGFR1FLT3NTRK1
SCHEMBL4987235 0.92 TGM2 (0.41) TGM2PDGFRBKDRFGFR1PRKAA2
SCHEMBL4987233 0.92 TGM2 (0.41) TGM2PDGFRBKDRFGFR1PRKAA2
SCHEMBL4994470 0.88 TGM2 (0.43) TGM2PDGFRBMDM2FLT3TNK2
SCHEMBL4994464 0.88 TGM2 (0.43) TGM2PDGFRBMDM2FLT3TNK2
SCHEMBL4997328 0.87 TGM2 (0.47) TGM2PDGFRBKDRFGFR1MDM2
SCHEMBL4997320 0.87 TGM2 (0.47) TGM2PDGFRBKDRFGFR1MDM2
SCHEMBL4987933 0.84 TGM2 (0.40) TGM2PDGFRBKDRFGFR1FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7414054-B2 3-(arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. (US) 2008-08-19 US disclosed
US-20060194863-A1 3-(Arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2006-08-31 US disclosed
US-7098236-B2 3-(arylamino)methylene-1,3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. (US) 2006-08-29 US disclosed
US-20060063940-A1 3-(arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2006-03-23 US disclosed
US-20060025413-A1 3-(arylamino)methylene-1,3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2006-02-02 US disclosed
US-20050228036-A1 3-(arylamino)methylene-1,3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2005-10-13 US disclosed
US-6765012-B2 FOR MODULATING TYROSINE KINASE SIGNAL TRANSDUCTION IN ORDER TO REGULATE, MODULATE AND/OR INHIBIT ABNORMAL CELL PROLIFERATION ALLERGAN, INC. 2004-07-20 US disclosed
US-20030225152-A1 3-(Arylamino)methylene-1, 3-dihydro-2h-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2003-12-04 US disclosed
US-20030199478-A1 3-(Arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2003-10-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050228036-A1 3-(arylamino)methylene-1,3-dihydro-2H-indol-2-ones as kinase inhibitors ERBB2, MKI67, CDK2 TGM2 3215/4885PDGFRB 307/4885KDR 256/4885
US-20030199478-A1 3-(Arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ERBB2, MKI67, CDK2 TGM2 3215/4885PDGFRB 307/4885KDR 256/4885
US-20060194863-A1 3-(Arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ERBB2, MKI67, CDK2 TGM2 3215/4885PDGFRB 307/4885KDR 256/4885
US-20060025413-A1 3-(arylamino)methylene-1,3-dihydro-2H-indol-2-ones as kinase inhibitors ERBB2, MKI67, CDK2 TGM2 3215/4885PDGFRB 307/4885KDR 256/4885
US-20060063940-A1 3-(arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ERBB2, MKI67, CDK2 TGM2 3215/4885PDGFRB 307/4885KDR 256/4885
US-20030225152-A1 3-(Arylamino)methylene-1, 3-dihydro-2h-indol-2-ones as kinase inhibitors ERBB2, MKI67, CDK2 TGM2 3215/4885PDGFRB 307/4885KDR 256/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.