SCHEMBL6696777

SCHEMBL6696777

NS(=O)(=O)c1ccc2c(c1)/C(=C/c1[nH]c3c(c1CCC(=O)O)CCCCC3)C(=O)N2

nearest known ligand 0.98

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SRC P12931 13/20 0.98
FGFR1 P11362 10/20 0.98
KDR P35968 10/20 0.98
EGFR P00533 3/20 0.98
AURKA O14965 6/20 0.77
PDGFRB P09619 9/20 0.73
FYN P06241 3/20 0.73
YES1 P07947 3/20 0.73
LCK P06239 2/20 0.71
AURKB Q96GD4 2/20 0.63

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
SCHEMBL6692783 0.91 SRC (0.84) SRCFGFR1KDREGFRAURKA
SCHEMBL6700630 0.91 SRC (0.98) SRCFGFR1KDREGFRAURKA
SCHEMBL6694002 0.89 SRC (0.86) SRCFGFR1KDREGFRAURKA
SCHEMBL6696417 0.89 SRC (0.80) SRCFGFR1KDREGFRAURKA
SCHEMBL3803707 0.87 AURKA (1.00) SRCFGFR1KDREGFRAURKA
SCHEMBL3803711 0.87 AURKA (1.00) SRCFGFR1KDREGFRAURKA
SCHEMBL6395902 0.87 SRC (0.79) SRCFGFR1KDREGFRAURKA
SCHEMBL6395894 0.87 SRC (0.79) SRCFGFR1KDREGFRAURKA
SCHEMBL6692356 0.86 SRC (0.78) SRCFGFR1KDREGFRAURKA
SCHEMBL6696411 0.86 SRC (0.78) SRCFGFR1KDREGFRAURKA

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
US-20040186160-A1 Hexahydro-cyclohepta-pyrrole oxindole as potent kinase inhibitors SUGEN, INC. 2004-09-23 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 (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-20040186160-A1 Hexahydro-cyclohepta-pyrrole oxindole as potent kinase inhibitors MAP3K15, MAP3K20, MAP3K19 SRC 162/4885FGFR1 782/4885KDR 749/4885

“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.