SCHEMBL6388381

SCHEMBL6388381

COc1ccc(C=C2C(=O)Nc3ccccc32)cc1-c1cccc(NC(C)=O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX4 Q9NPH5 1/20 0.60
GSK3B P49841 3/20 0.57
ERBB2 P04626 1/20 0.56
DHFR P00374 1/20 0.54
RET P07949 1/20 0.52
PLK4 O00444 1/20 0.50
PLK1 P53350 1/20 0.50
LRRK2 Q5S007 1/20 0.49
PDPK1 O15530 1/20 0.49
AKT2 P31751 1/20 0.49
PSD A5PKW4 1/20 0.48
CSNK1D P48730 3/20 0.47
CSNK1A1 P48729 2/20 0.47
CSNK1E P49674 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
GMNN O75496 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
CYP1A2 P05177 1/20 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
SCHEMBL6388380 1.00 NOX4 (0.60) NOX4GSK3BERBB2DHFRRET
SCHEMBL6390614 0.93 NOX4 (0.60) NOX4GSK3BERBB2RETLRRK2
SCHEMBL6390621 0.93 NOX4 (0.60) NOX4GSK3BERBB2RETLRRK2
SCHEMBL7989495 0.90 NOX4 (0.51) NOX4GSK3BERBB2DHFRRET
SCHEMBL7989491 0.90 NOX4 (0.51) NOX4GSK3BERBB2DHFRRET
SCHEMBL7717894 0.85 GSK3B (0.52) NOX4GSK3BERBB2DHFRRET
SCHEMBL6408143 0.84 ERBB2 (0.69) ERBB2DHFRRETPLK4PLK1
SCHEMBL6396491 0.84 ERBB2 (0.69) ERBB2DHFRRETPLK4PLK1
SCHEMBL8001367 0.80 ERBB2 (0.64) ERBB2DHFRPLK4PLK1CSNK1D
SCHEMBL8001370 0.80 ERBB2 (0.64) ERBB2DHFRPLK4PLK1CSNK1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6855730-B2 3-methylidenyl-2-indolinone modulators of protein kinase SUGEN, INC. (US) 2005-02-15 US claimed
US-20040024010-A1 3-methylidenyl-2-indolinone modulators of protein kinase SUGEN, INC. 2004-02-05 US claimed
US-6878733-B1 Formulations for pharmaceutical agents ionizable as free acids or free bases SUGEN, INC. (US) 2005-04-12 US disclosed
US-6855730-B2 3-methylidenyl-2-indolinone modulators of protein kinase SUGEN, INC. (US) 2005-02-15 US disclosed
US-20040024010-A1 3-methylidenyl-2-indolinone modulators of protein kinase SUGEN, INC. 2004-02-05 US disclosed
US-6531502-B1 Antitumor SUGEN, INC. 2003-03-11 US disclosed
WO-2000008202-A2 3-METHYLIDENYL-2-INDOLINONE MODULATORS OF PROTEIN KINASE SUGEN, INC. (US) 2000-02-17 WO 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 (1 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-20040024010-A1 3-methylidenyl-2-indolinone modulators of protein kinase DMPK, MAP4K3, MAP3K20 NOX4 2595/4885GSK3B 419/4885ERBB2 262/4885

“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.