SCHEMBL4155422

SCHEMBL4155422

O=CC(OCc1ccccn1)N1CCN(c2ccc(F)cc2Cl)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.47
NOX4 Q9NPH5 2/20 0.39
NPY2R P49146 1/20 0.38
ALDH1A1 P00352 3/20 0.37
ALOX15 P16050 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GFER P55789 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
SLC6A2 P23975 2/20 0.36
SLC6A3 Q01959 2/20 0.36
SLC6A4 P31645 1/20 0.36
HTR2C P28335 2/20 0.35
NMT1 P30419 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 1/20 0.34
HTR2B P41595 1/20 0.34
SYK P43405 2/20 0.34

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
SCHEMBL27756986 0.84 GRM5 (0.50) GRM5NOX4NPY2RALDH1A1ALOX15
SCHEMBL4609669 0.84 GRM5 (0.56) GRM5NPY2RSLC6A2SLC6A3SLC6A4
SCHEMBL4608859 0.81 GRM5 (0.48) GRM5SLC6A2SLC6A3SLC6A4HTR2C
SCHEMBL4611088 0.80 SMN1; SMN2 (0.43) GRM5ALDH1A1NPSR1GFERKDM4E
SCHEMBL4608995 0.79 GRM5 (0.45) GRM5ALDH1A1HSD17B10KDM4ESLC6A2
SCHEMBL27756982 0.78 GRM5 (0.55) GRM5NOX4NPY2RALDH1A1ALOX15
SCHEMBL4610011 0.78 SLC6A2 (0.47) GRM5KDM4ESLC6A2SLC6A3SLC6A4
SCHEMBL4608127 0.77 GRM5 (0.41) GRM5NPY2RALDH1A1LMNASLC6A2
SCHEMBL4609680 0.77 GRM5 (0.59) GRM5SLC6A2SLC6A3SLC6A4
SCHEMBL4609000 0.76 SLC6A2 (0.43) GRM5NPY2RSLC6A2SLC6A3SLC6A4

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
US-20090023711-A1 Piperazines and Piperidines as Mglur5 Potentiators ASTRAZENECA AB (SE) 2009-01-22 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090023711-A1 Piperazines and Piperidines as Mglur5 Potentiators GRM5, GRM1, GRIN1 GRM5 1/4885NOX4 3253/4885NPY2R 217/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.