SCHEMBL4668025

SCHEMBL4668025

CCCOc1cccc(Oc2ccc(C3C(O)CNCC3OCc3ccc4c(c3)N(CCCOC)CCO4)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
REN P00797 16/20 0.43
AXL P30530 1/20 0.33
MERTK Q12866 1/20 0.33
GRM5 P41594 1/20 0.32

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
SCHEMBL13161120 1.00 REN (0.43) RENAXLMERTKGRM5
SCHEMBL13161131 0.97 REN (0.47) RENAXLMERTK
SCHEMBL3277915 0.97 REN (0.47) RENAXLMERTK
SCHEMBL8434744 0.97 REN (0.47) RENAXLMERTK
SCHEMBL13161138 0.96 REN (0.44) RENAXLMERTKGRM5
SCHEMBL8430145 0.96 REN (0.44) RENAXLMERTKGRM5
SCHEMBL3464666 0.96 REN (0.44) RENAXLMERTKGRM5
SCHEMBL13161112 0.95 REN (0.42) RENAXLMERTKGRM5
SCHEMBL3274355 0.95 REN (0.42) RENAXLMERTKGRM5
SCHEMBL8428845 0.95 REN (0.42) RENAXLMERTKGRM5

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
EP-1987834-A2 Substituted piperidines as therapeutic compounds Speedel Experimenta AG (CH) 2008-11-05 EP disclosed