SCHEMBL15085286

SCHEMBL15085286

O=C1CCc2c(Oc3ccc4c(c3)[C@@H]3C(O4)[C@H]3C(=O)O)ccnc2N1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 7/20 1.00
BRAF P15056 19/20 0.73
EGFR P00533 5/20 0.66

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
SCHEMBL22279526 1.00 RAF1 (1.00) RAF1BRAFEGFR
SCHEMBL16379948 1.00 RAF1 (1.00) RAF1BRAFEGFR
SCHEMBL30584457 1.00 RAF1 (1.00) RAF1BRAFEGFR
SCHEMBL15085291 1.00 RAF1 (1.00) RAF1BRAFEGFR
SCHEMBL16380189 1.00 RAF1 (1.00) RAF1BRAFEGFR
SCHEMBL18922180 1.00 RAF1 (1.00) RAF1BRAFEGFR
SCHEMBL17800204 1.00 RAF1 (1.00) RAF1BRAFEGFR
SCHEMBL15085420 0.92 RAF1 (0.84) RAF1BRAFEGFR
SCHEMBL18922271 0.92 RAF1 (0.84) RAF1BRAFEGFR
SCHEMBL18922160 0.92 RAF1 (0.84) RAF1BRAFEGFR

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-2013097224-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BEIGENE, LTD. (KY) 2013-07-04 WO disclosed