SCHEMBL17844400

SCHEMBL17844400

Nc1ncccc1OCC1CCN(C(=O)O)CC1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AXL P30530 9/20 0.45
DCPS Q96C86 2/20 0.45
RBP4 P02753 2/20 0.43
TTR P02766 1/20 0.43
LTA4H P09960 1/20 0.43
MAPK14 Q16539 1/20 0.43
GRIN2B Q13224 1/20 0.43
MAP4K4 O95819 1/20 0.42
PRKCQ Q04759 1/20 0.42
KDM4E B2RXH2 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
SCHEMBL17837745 0.83 GPR119 (0.55) AXLKDM4E
SCHEMBL17844410 0.80 AXL (0.48) AXL
SCHEMBL27734970 0.79 RBP4 (0.47) RBP4TTRKDM4E
SCHEMBL9748123 0.78 MCHR1 (0.56) DCPSLTA4HMAPK14MAP4K4
SCHEMBL17844439 0.78 MAP4K4 (0.48) AXLDCPSMAP4K4KDM4E
SCHEMBL23365120 0.77 ALDH1A1 (0.52) RBP4MAPK14KDM4E
SCHEMBL23365193 0.77 HPGD (0.55) RBP4TTRMAPK14KDM4E
SCHEMBL619980 0.77 DCPS (0.41) AXLDCPSRBP4
SCHEMBL5210714 0.75 ALDH1A1 (0.51) RBP4KDM4E
SCHEMBL3342669 0.75 ABCB1 (0.52) RBP4MAPK14KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233829-A1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS Pfizer Inc (US) 2017-10-25 EP disclosed
WO-2016097918-A1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS PFIZER INC. (US) 2016-06-23 WO disclosed