Sugi Predict

Sugi Predict / Compounds / SCHEMBL20003908

SCHEMBL20003908

SCHEMBL20003908

Cc1ccc(NC(=O)C2(C(=O)Nc3ccc(Oc4ccnc5nc(N6CCN(C)CC6)cnc45)c(F)c3)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 13/20 0.56
▸ AXL P30530 6/20 0.55
▸ BRAF P15056 2/20 0.50
▸ KDR P35968 4/20 0.49
▸ RET P07949 1/20 0.49
▸ KIT P10721 1/20 0.49
▸ PDGFRA P16234 1/20 0.49
▸ FLT3 P36888 1/20 0.49
▸ MERTK Q12866 1/20 0.46

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
SCHEMBL18256819 0.95 AXL (0.61) METAXLBRAFKDRRET
SCHEMBL20003932 0.92 MET (0.55) METAXLKDRRETKIT
SCHEMBL20003694 0.87 MET (0.65) METAXLKDRRETKIT
SCHEMBL18256958 0.85 MET (0.55) METAXLKDRRETKIT
SCHEMBL18256822 0.85 MET (0.60) METAXLBRAFKDRRET
SCHEMBL20003927 0.82 MET (0.65) METAXLKDRRETKIT
SCHEMBL20003625 0.81 MET (0.56) METAXLKDRRETKIT
SCHEMBL20003721 0.79 MET (0.55) METAXLKDRRETKIT
SCHEMBL18256881 0.79 MET (0.55) METAXLKDRRETKIT
SCHEMBL18256823 0.79 MET (0.60) METAXLBRAFKDRRET

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-3299369-A1 PYRIDO-AZAHETERECYDIC COMPOUND AND PREPARATION METHOD AND USE THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2018-03-28 — — EP disclosed