SCHEMBL3650235

SCHEMBL3650235

CCOC(=O)C1CCN(CCOc2cccc(Nc3ncc(-c4ccc(OC(F)F)cc4)cn3)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.49
▸ HRH3 Q9Y5N1 3/20 0.48
▸ EGFR P00533 3/20 0.47
▸ BTK Q06187 3/20 0.47
▸ KCNH2 Q12809 4/20 0.47
▸ ALDH1A1 P00352 2/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.43
▸ SYK P43405 2/20 0.42
▸ HTR1A P08908 1/20 0.42
▸ DRD2 P14416 1/20 0.42
▸ HTR7 P34969 1/20 0.42
▸ HTR6 P50406 1/20 0.42
▸ SIGMAR1 Q99720 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ AIMP2 Q13155 1/20 0.41

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
SCHEMBL13472143 0.90 LTA4H (0.51) LTA4HHRH3KCNH2ALDH1A1KMT2A
SCHEMBL3646162 0.90 EGFR (0.50) LTA4HEGFRBTKSYKHTR1A
SCHEMBL3646352 0.89 LTA4H (0.45) LTA4HHRH3EGFRBTKKCNH2
SCHEMBL3644483 0.85 LMNA (0.45) LTA4HHRH3KCNH2ALDH1A1KMT2A
SCHEMBL13472161 0.84 LTA4H (0.45) LTA4HHRH3EGFRKCNH2ALDH1A1
SCHEMBL3651384 0.82 EGFR (0.42) LTA4HEGFRBTKALDH1A1KMT2A
SCHEMBL3647473 0.82 EGFR (0.44) LTA4HEGFRBTK
SCHEMBL1735396 0.81 KCNH2 (0.55) LTA4HHRH3KCNH2ALDH1A1KMT2A
SCHEMBL13472142 0.81 LTA4H (0.46) LTA4HHRH3EGFRBTKSYK
SCHEMBL3650361 0.81 CSF1R (0.41) LTA4HHRH3EGFRBTKKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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