Sugi Predict

Sugi Predict / Compounds / SCHEMBL13618355

SCHEMBL13618355

SCHEMBL13618355

C=Cc1ccc(Nc2nc3cc(Oc4ccnc(C(=O)NCCc5cccc(OC)c5)c4)ccc3n2C)cc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RAF1 P04049 18/20 0.61
▸ BRAF P15056 18/20 0.61
▸ LCK P06239 1/20 0.51
▸ FYN P06241 1/20 0.51
▸ PDGFRB P09619 1/20 0.51
▸ KIT P10721 1/20 0.51
▸ FLT1 P17948 1/20 0.51
▸ FLT4 P35916 1/20 0.51
▸ KDR P35968 1/20 0.51

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
SCHEMBL13210233 0.91 BRAF (0.76) RAF1BRAFLCKFYNPDGFRB
SCHEMBL13617987 0.87 RAF1 (0.61) RAF1BRAFLCKFYNPDGFRB
SCHEMBL13210238 0.83 BRAF (0.80) RAF1BRAFLCKFYNPDGFRB
SCHEMBL2895155 0.82 RAF1 (0.69) RAF1BRAFLCKFYNPDGFRB
SCHEMBL13618155 0.81 BRAF (0.73) RAF1BRAFLCKFYNPDGFRB
SCHEMBL2889975 0.80 RAF1 (0.70) RAF1BRAFLCKFYNPDGFRB
SCHEMBL13210216 0.79 BRAF (0.81) RAF1BRAFLCKFYNPDGFRB
SCHEMBL2892909 0.79 BRAF (0.69) RAF1BRAFLCKFYNPDGFRB
SCHEMBL2893077 0.79 RAF1 (0.69) RAF1BRAFLCKFYNPDGFRB
SCHEMBL2891585 0.79 BRAF (0.69) RAF1BRAFLCKFYNPDGFRB

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
EP-1499311-B1 SUBSTITUTED BENZAZOLES AND USE THEREOF AS RAF KINASE INHIBITORS NOVARTIS VACCINES & DIAGNOSTIC (US) 2009-11-04 — — EP disclosed