SCHEMBL6979446

SCHEMBL6979446

COc1ccc(Nc2ncc(Br)c(Nc3ccc(OC)c(OC)c3OC)n2)c(OC)c1OC

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.63
PTK2 Q05397 1/20 0.52
ALK Q9UM73 2/20 0.51
CDK19 Q9BWU1 1/20 0.51
ULK1 O75385 3/20 0.51
IGF1R P08069 4/20 0.50
ZAP70 P43403 2/20 0.50

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
SCHEMBL2716652 0.79 EGFR (1.00) EGFR
SCHEMBL1707650 0.78 EGFR (0.63) EGFRPTK2ALKCDK19ULK1
SCHEMBL653918 0.76 ZAP70 (0.68) EGFRPTK2ALKCDK19ULK1
SCHEMBL18808202 0.76 EGFR (0.65) EGFR
SCHEMBL24728127 0.75 SYK (0.62) EGFRPTK2ALKULK1IGF1R
SCHEMBL1116484 0.75 PTK2 (0.74) EGFRPTK2ALKCDK19ULK1
SCHEMBL1707782 0.73 ZAP70 (0.59) EGFRPTK2ALKULK1IGF1R
SCHEMBL17547549 0.73 PTK2 (0.72) EGFRPTK2ALKCDK19ULK1
SCHEMBL23764834 0.72 MAPK8 (0.71) PTK2ALKCDK19ULK1IGF1R
SCHEMBL23764833 0.72 PTK2 (0.71) EGFRPTK2ALKCDK19ULK1

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-0862560-B1 SUBSTITUTED 2-ANILINOPYRIMIDINES USEFUL AS PROTEIN KINASE INHIBITORS CELLTECH THERAPEUTICS LTD (GB) 2003-04-02 EP disclosed