SCHEMBL7095265

SCHEMBL7095265

COc1cc(Nc2ccnc3cc(-c4csc(C5OCCO5)c4)ccc23)c(Cl)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 18/20 0.54
FYN P06241 2/20 0.45
EGFR P00533 1/20 0.41
MAP2K1 Q02750 1/20 0.41
GAK O14976 1/20 0.41
ABL1 P00519 1/20 0.39
RET P07949 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
SCHEMBL3213123 0.83 SRC (0.69) SRCFYNEGFRMAP2K1ABL1
SCHEMBL7096102 0.82 SRC (0.56) SRCFYNEGFRMAP2K1GAK
SCHEMBL3224350 0.73 SRC (0.61) SRCFYNEGFRMAP2K1GAK
SCHEMBL7015603 0.72 SRC (0.73) SRCEGFRGAKABL1
SCHEMBL7012160 0.72 SRC (0.73) SRCEGFRGAKABL1
SCHEMBL7148997 0.72 SRC (0.73) SRCFYNEGFRMAP2K1
SCHEMBL7097985 0.72 SRC (0.73) SRCFYNEGFRMAP2K1
SCHEMBL7104720 0.71 SRC (0.72) SRCFYNEGFRMAP2K1
SCHEMBL7017167 0.71 SRC (0.58) SRCFYNEGFRGAK
SCHEMBL7095983 0.70 SRC (0.58) SRCFYNEGFRMAP2K1

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-1268431-A1 3-CYANOQUINOLINES,3-CYANO-1,6-NAPHTHYRIDINES, AND 3-CYANO-1,7-NAPHTHYRIDINES AS PROTEIN KINASE INHIBITORS Wyeth (US) 2003-01-02 EP disclosed
WO-2001072711-A1 3-CYANOQUINOLINES,3-CYANO-1,6-NAPHTHYRIDINES, AND 3-CYANO-1,7-NAPHTHYRIDINES AS PROTEIN KINASE INHIBITORS WYETH (US) 2001-10-04 WO disclosed