SCHEMBL7768774

SCHEMBL7768774

CCC(C)(C)[CH]CCCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.43
HTR1A P08908 1/20 0.43
ADRA2A P08913 1/20 0.43
CHRM1 P11229 1/20 0.43
DRD1 P21728 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
ADRA1A P35348 1/20 0.43
OPRM1 P35372 1/20 0.43
DRD3 P35462 1/20 0.43
SLC6A3 Q01959 1/20 0.43
KCNH2 Q12809 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SIGMAR1 Q99720 4/20 0.39
MAOA P21397 1/20 0.39
AOC3 Q16853 1/20 0.39
MAOB P27338 1/20 0.38

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
SCHEMBL7405977 0.89 GPR52 (0.41) CHRM2HTR1AADRA2ACHRM1DRD1
SCHEMBL9214298 0.85 SLC6A2 (0.44) SLC6A2L3MBTL1POLBMEN1KMT2A
SCHEMBL9848958 0.80 MAOB (0.46) SLC6A2L3MBTL1SIGMAR1MAOAMAOB
SCHEMBL5570918 0.78 L3MBTL1 (0.40) CHRM2HTR1AADRA2ACHRM1DRD1
SCHEMBL6049171 0.76 CHRM2 (0.42) CHRM2HTR1AADRA2ACHRM1DRD1
SCHEMBL5610556 0.75 FAAH (0.44) ADRA1ASLC6A3L3MBTL1SIGMAR1MAOA
SCHEMBL5795177 0.72 CHRM2 (0.48) CHRM2HTR1AADRA2ACHRM1DRD1
SCHEMBL430012 0.71 SIGMAR1 (0.54) CHRM2HTR1AADRA2ACHRM1DRD1
SCHEMBL19031840 0.71 EPHX2 (0.52) CHRM2HTR1AADRA2ACHRM1DRD1
SCHEMBL14638684 0.71 KCNH2 (0.47) CHRM2HTR1AADRA2ACHRM1DRD1

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
EP-1105112-A2 COMPOSITIONS AND USES FOR VISION AND MEMORY DISORDERS GPI NIL Holdings, Inc. (US) 2001-06-13 EP disclosed
WO-2000009108-A2 COMPOSITIONS AND USES FOR VISION AND MEMORY DISORDERS GPI NIL HOLDINGS, INC. (US) 2000-02-24 WO disclosed