SCHEMBL8938240

SCHEMBL8938240

CNC(=O)c1ccc(CCN2CCC[C@@H](OC(c3ccccc3)c3ccccc3)C2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.52
GRM7 Q14831 1/20 0.52
GRM3 Q14832 1/20 0.52
SLC6A2 P23975 5/20 0.47
SLC6A4 P31645 5/20 0.47
SLC6A3 Q01959 5/20 0.47
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
OPRK1 P41145 2/20 0.45
DRD3 P35462 2/20 0.45
NPC1 O15118 1/20 0.45
MLNR O43193 1/20 0.45
NR1I2 O75469 1/20 0.45
EGFR P00533 1/20 0.45
LMNA P02545 1/20 0.45
ERBB2 P04626 1/20 0.45
FYN P06241 1/20 0.45
CHRM2 P08172 1/20 0.45
CHRM4 P08173 1/20 0.45
ABCB1 P08183 1/20 0.45

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
SCHEMBL8938359 0.90 GRM5 (0.50) GRM5GRM7GRM3SLC6A2SLC6A4
SCHEMBL8938288 0.89 SLC6A2 (0.50) GRM5GRM7GRM3SLC6A2SLC6A4
SCHEMBL8938185 0.89 SLC6A2 (0.50) GRM5GRM7GRM3SLC6A2SLC6A4
SCHEMBL9255555 0.89 GRM5 (0.48) GRM5GRM7GRM3SLC6A2SLC6A4
SCHEMBL8938444 0.87 SLC6A2 (0.47) GRM5GRM7GRM3SLC6A2SLC6A4
SCHEMBL8938538 0.87 GRM5 (0.51) GRM5GRM7GRM3SLC6A2SLC6A4
SCHEMBL8938508 0.87 GRM5 (0.51) GRM5GRM7GRM3SLC6A2SLC6A4
SCHEMBL8938314 0.85 SLC6A2 (0.48) GRM5GRM7GRM3SLC6A2SLC6A4
SCHEMBL8938352 0.84 DRD3 (0.51) GRM5GRM7GRM3SLC6A2SLC6A4
SCHEMBL8938637 0.84 SIGMAR1 (0.51) SLC6A2SLC6A4SLC6A3DRD3CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5534626-A SELECTIVE MUSCARINIC RECEPTOR ANTAGONIST INTERMEDIATES PFIZER INC. (US) 1996-07-09 US disclosed
EP-0350309-B1 PIPERIDINE DERIVATIVES Pfizer Limited (GB) 1992-11-11 EP disclosed
US-5089505-A Anticholinergic agents PFIZER INC. (US) 1992-02-18 US disclosed
EP-0350309-A1 Piperidine derivatives Pfizer Limited (GB) 1990-01-10 EP disclosed