SCHEMBL8262149

SCHEMBL8262149

NCC1CCN(CC2(C(=O)O)CCC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.38
PLAT P00750 1/20 0.38
LMNA P02545 1/20 0.38
KDM1A O60341 2/20 0.36
NCF1 P14598 1/20 0.36
CYP2D6 P10635 1/20 0.36
CHRM2 P08172 3/20 0.35
CHRM1 P11229 3/20 0.35
CHRM3 P20309 3/20 0.35
ARG1 P05089 5/20 0.34
CYP2C19 P33261 1/20 0.34
CXCR4 P61073 1/20 0.33
HRH1 P35367 1/20 0.31
TPSAB1 Q15661 1/20 0.30
TPSD1 Q9BZJ3 1/20 0.30
TPSG1 Q9NRR2 1/20 0.30

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
SCHEMBL3296699 0.95 CYP2C19 (0.41) PLGPLATLMNAKDM1ANCF1
SCHEMBL1970445 0.93 PLG (0.40) PLGPLATLMNAKDM1ANCF1
SCHEMBL1970098 0.86 PLG (0.35) PLGPLATLMNAKDM1ANCF1
SCHEMBL1969857 0.82 HTR2A (0.39) KDM1ACYP2D6ARG1CYP2C19HRH1
SCHEMBL1968493 0.82 CYP4F2 (0.37) PLGPLATLMNAKDM1ANCF1
SCHEMBL22629578 0.80 HTR7 (0.40) KDM1ACYP2C19
SCHEMBL3294534 0.79 ARG1 (0.41) CYP2D6ARG1CYP2C19HRH1
SCHEMBL1970718 0.79 CYP4F2 (0.40) PLGPLATLMNAKDM1ANCF1
SCHEMBL5325486 0.75 CYP2C19 (0.48) LMNAKDM1ACYP2C19HRH1
SCHEMBL3589272 0.75 CYP4F2 (0.34) NCF1CHRM2CHRM1CHRM3

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-2006090279-A1 OXYINDOLE DERIVATIVES AS 5HT4 RECEPTOR AGONISTS PFIZER JAPAN INC. (JP) 2006-08-31 WO disclosed