SCHEMBL3647478

SCHEMBL3647478

CC(Cc1cccc(Nc2ncc(-c3ccc(OC(F)F)cc3)cn2)c1)N1CCC(C(=O)O)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 2/20 0.44
▸ BTK Q06187 2/20 0.44
▸ GFRA3 O60609 5/20 0.39
▸ RET P07949 2/20 0.39
▸ IDH2 P48735 1/20 0.37
▸ MET P08581 2/20 0.37
▸ GFRA2 O00451 3/20 0.36
▸ GFRA1 P56159 3/20 0.36
▸ PTK2 Q05397 1/20 0.35
▸ AOC3 Q16853 1/20 0.35
▸ UBE2M P61081 4/20 0.35
▸ DCUN1D1 Q96GG9 4/20 0.35
▸ MELK Q14680 1/20 0.35
▸ ROCK2 O75116 2/20 0.35
▸ ABL1 P00519 1/20 0.35

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
SCHEMBL3652226 0.91 EGFR (0.46) EGFRBTKGFRA3RETIDH2
SCHEMBL3651384 0.91 EGFR (0.42) EGFRBTKPTK2
SCHEMBL3646358 0.91 EGFR (0.43) EGFRBTKGFRA3RETIDH2
SCHEMBL3651441 0.87 EGFR (0.46) EGFRBTKGFRA3RETMELK
SCHEMBL3647130 0.85 EGFR (0.45) EGFRBTKGFRA3RETIDH2
SCHEMBL3644487 0.83 EGFR (0.43) EGFRBTKGFRA3RETIDH2
SCHEMBL5049010 0.81 UBE2M (0.44) PTK2UBE2MDCUN1D1
SCHEMBL3651931 0.81 GRM5 (0.40) EGFRBTKPTK2MELK
SCHEMBL3646162 0.80 EGFR (0.50) EGFRBTK
SCHEMBL3650240 0.80 EGFR (0.47) EGFRBTKGFRA3RETIDH2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2190825-A1 5- (4- (HALOALKOXY) PHENYL) PYRIMIDINE-2-AMINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-06-02 — — EP claimed
WO-2009026276-A1 5- (4- (HALOALKOXY) PHENYL) PYRIMIDINE-2-AMINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-02-26 — — WO claimed
US-8293757-B2 5-(4-(haloalkoxy)phenyl) pyrimidine-2-amine compounds and compositions as kinase inhibitors IRM LLC (BM) 2012-10-23 — — US disclosed
EP-2190825-A1 5- (4- (HALOALKOXY) PHENYL) PYRIMIDINE-2-AMINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-06-02 — — EP disclosed
WO-2009026276-A1 5- (4- (HALOALKOXY) PHENYL) PYRIMIDINE-2-AMINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-02-26 — — WO disclosed
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