SCHEMBL3651887

SCHEMBL3651887

O=C(O)C1CCN(Cc2ccc(Nc3ncc(-c4ccc(OC(F)F)cc4)cn3)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 1/20 0.47
▸ S1PR5 Q9H228 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ HRH3 Q9Y5N1 1/20 0.46
▸ CHRM4 P08173 1/20 0.45
▸ JAK2 O60674 2/20 0.43
▸ SYK P43405 1/20 0.43
▸ PRKAA2 P54646 2/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ MCHR1 Q99705 1/20 0.42
▸ LTA4H P09960 2/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ JAK1 P23458 1/20 0.42
▸ JAK3 P52333 1/20 0.42

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
SCHEMBL3647442 0.91 LTA4H (0.42) PTK2S1PR5POLBHRH3CHRM4
SCHEMBL3651441 0.89 EGFR (0.46) CHRM4JAK2PRKAA2KMT2AJAK3
SCHEMBL12442985 0.89 L3MBTL1 (0.42) PTK2S1PR5POLBHRH3CHRM4
SCHEMBL3644492 0.88 LTA4H (0.49) PTK2S1PR5HRH3JAK2SYK
SCHEMBL3653301 0.87 ACHE (0.52) PTK2S1PR5HRH3CHRM4PRKAA2
SCHEMBL3650207 0.87 GPR6 (0.41) PTK2S1PR5POLBCHRM4JAK2
SCHEMBL3652561 0.87 EGFR (0.40) PTK2S1PR5POLBCHRM4KMT2A
SCHEMBL27807596 0.86 GRM5 (0.39) PTK2S1PR5POLBSYK
SCHEMBL3650935 0.86 ACHE (0.40) PTK2S1PR5POLBCHRM4SYK
SCHEMBL12443126 0.84 EGFR (0.39) POLBHRH3CHRM4JAK2SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101784530-A 5- (4- (haloalkoxy) phenyl) pyrimidine-2-amine compounds and compositions as kinase inhibitors IRM LLC 2010-07-21 — — CN claimed
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
US-8293757-B2 5-(4-(haloalkoxy)phenyl) pyrimidine-2-amine compounds and compositions as kinase inhibitors IRM LLC (BM) 2012-10-23 — — US disclosed
US-8293757-B2 5-(4-(haloalkoxy)phenyl) pyrimidine-2-amine compounds and compositions as kinase inhibitors IRM LLC (BM) 2012-10-23 — — US disclosed
CN-101784530-A 5- (4- (haloalkoxy) phenyl) pyrimidine-2-amine compounds and compositions as kinase inhibitors IRM LLC 2010-07-21 — — CN 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
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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