SCHEMBL2637388

SCHEMBL2637388

CNC(=O)c1cc(-c2cnn(CC(C)(C)O)c2)ccc1Nc1nc(Nc2ccc(CP(=O)(O)O)cc2)ncc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 16/20 0.43
▸ JAK2 O60674 1/20 0.42
▸ NTRK1 P04629 1/20 0.42
▸ TYK2 P29597 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ JAK3 P52333 1/20 0.42
▸ PTK2B Q14289 1/20 0.42
▸ NTRK3 Q16288 1/20 0.42
▸ NTRK2 Q16620 1/20 0.42
▸ FGFR1 P11362 4/20 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
SCHEMBL2637310 0.92 FGFR1 (0.47) PTK2JAK2NTRK1TYK2KDR
SCHEMBL2032579 0.91 PTK2 (0.52) PTK2JAK2NTRK1TYK2KDR
SCHEMBL2636967 0.91 FGFR1 (0.45) PTK2JAK2NTRK1TYK2KDR
SCHEMBL2637244 0.90 PTK2 (0.43) PTK2JAK2NTRK1TYK2KDR
SCHEMBL14767996 0.90 PTK2 (0.45) PTK2JAK2NTRK1TYK2KDR
SCHEMBL9273872 0.90 HDAC3 (0.44) PTK2JAK2NTRK1TYK2KDR
SCHEMBL2637116 0.89 KDR (0.51) PTK2JAK2NTRK1TYK2KDR
SCHEMBL2637338 0.89 PTK2 (0.42) PTK2JAK2NTRK1TYK2KDR
SCHEMBL2032585 0.89 PTK2 (0.44) PTK2JAK2NTRK1TYK2KDR
SCHEMBL2636855 0.88 FGFR1 (0.42) PTK2JAK2NTRK1TYK2KDR

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-8399433-B2 Amino pyrimidine anticancer compounds OSI Pharmaceuticals, LLC (US) 2013-03-19 — — US disclosed
EP-2438056-A2 AMINO PYRIMIDINE ANTICANCER COMPOUNDS OSI Pharmaceuticals, LLC (US) 2012-04-11 — — EP disclosed
WO-2010141406-A2 AMINO PYRIMIDINE ANTICANCER COMPOUNDS OSI PHARMACEUTICALS, INC. (US) 2010-12-09 — — WO disclosed
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