SCHEMBL1902180

SCHEMBL1902180

O=CC(OCc1ccccc1F)N1CCN(c2ccc(Cl)cc2Cl)CC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
SLC6A2 P23975 4/20 0.42
SLC6A4 P31645 4/20 0.42
SLC6A3 Q01959 1/20 0.42
GRM5 P41594 6/20 0.41
NPY2R P49146 1/20 0.39
MAPT P10636 3/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
DRD2 P14416 3/20 0.36
DRD4 P21917 3/20 0.36
MC4R P32245 1/20 0.36
HTR1A P08908 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL4610011 0.89 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3GRM5MAPT
SCHEMBL4608926 0.88 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3GRM5DRD2
SCHEMBL4610088 0.84 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3GRM5DRD4
SCHEMBL4608428 0.83 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3GRM5MC4R
SCHEMBL4609000 0.82 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3GRM5NPY2R
SCHEMBL4608871 0.79 KDM4E (0.41) SLC6A2SLC6A4SLC6A3GRM5MAPT
SCHEMBL4608750 0.78 GRM5 (0.56) SLC6A2SLC6A4SLC6A3GRM5
SCHEMBL4609669 0.78 GRM5 (0.56) KMT2ASLC6A2SLC6A4SLC6A3GRM5
SCHEMBL4608995 0.78 GRM5 (0.45) SLC6A2SLC6A4SLC6A3GRM5ALDH1A1
SCHEMBL4610110 0.78 GRM5 (0.42) KMT2ASLC6A2SLC6A4SLC6A3GRM5

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
US-7935703-B2 Piperazines and piperidines as Mglur5 potentiators ASTRAZENECA AB (SE) 2011-05-03 US disclosed
US-20090023711-A1 Piperazines and Piperidines as Mglur5 Potentiators ASTRAZENECA AB (SE) 2009-01-22 US disclosed

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 KMT2A 1247/4885SLC6A2 509/4885SLC6A4 531/4885

“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.