SCHEMBL6256014

SCHEMBL6256014

Nc1nccc(/C=C/c2c(-c3ccc(Br)cc3)nc3sccn23)n1.Nc1nccc(/C=C/c2c(-c3cccc(C(F)(F)F)c3)nc3sccn23)n1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TEK Q02763 14/20 0.69
KDR P35968 12/20 0.69
FLT1 P17948 11/20 0.69
NR1I3 Q14994 2/20 0.39
GRM4 Q14833 1/20 0.39

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
SCHEMBL6256018 1.00 TEK (0.69) TEKKDRFLT1NR1I3GRM4
SCHEMBL4767249 0.94 TEK (0.74) TEKKDRFLT1GRM4
SCHEMBL4767246 0.94 TEK (0.74) TEKKDRFLT1GRM4
SCHEMBL4774625 0.88 TEK (0.80) TEKKDRFLT1NR1I3GRM4
SCHEMBL4774631 0.88 TEK (0.80) TEKKDRFLT1NR1I3GRM4
SCHEMBL4764883 0.82 TEK (1.00) TEKKDRFLT1GRM4
SCHEMBL4764887 0.82 TEK (1.00) TEKKDRFLT1GRM4
SCHEMBL4774488 0.81 TEK (1.00) TEKKDRFLT1GRM4
SCHEMBL4774486 0.81 TEK (1.00) TEKKDRFLT1GRM4
SCHEMBL4765010 0.79 TEK (0.64) TEKKDRFLT1NR1I3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1575963-A1 THERAPEUTIC AGENTS AstraZeneca AB (SE) 2005-09-21 EP disclosed
WO-2004058776-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2004-07-15 WO disclosed