SCHEMBL17857701

SCHEMBL17857701

CCNC(=O)c1cc(N2CCC(COc3cc(C4=C(C)N(C)NN4)cnc3N)CC2)nc(O[C@H](C)COC)n1

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AXL P30530 20/20 0.74

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
SCHEMBL17837560 0.85 AXL (0.83) AXL
SCHEMBL17837402 0.85 AXL (1.00) AXL
SCHEMBL21240819 0.85 AXL (1.00) AXL
SCHEMBL17837549 0.85 AXL (1.00) AXL
SCHEMBL17837610 0.85 AXL (1.00) AXL
SCHEMBL21240849 0.84 AXL (1.00) AXL
SCHEMBL17837445 0.84 AXL (1.00) AXL
SCHEMBL17837894 0.84 AXL (0.74) AXL
SCHEMBL17837723 0.84 AXL (0.76) AXL
SCHEMBL18621877 0.83 AXL (0.73) AXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016097918-A1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS PFIZER INC. (US) 2016-06-23 WO disclosed