SCHEMBL9869620

SCHEMBL9869620

CN(CCCC1(c2ccccc2)CC(=O)NC(=O)C1)CCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 10/20 0.49
SLC6A4 P31645 2/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A3 Q01959 1/20 0.40
TMEM97 Q5BJF2 1/20 0.39
FDPS P14324 1/20 0.39
SLC6A9 P48067 1/20 0.38
TAAR1 Q96RJ0 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
SCHEMBL9304044 0.93 SIGMAR1 (0.42) SIGMAR1SLC6A4SLC6A2SLC6A3TMEM97
SCHEMBL9303335 0.92 SIGMAR1 (0.45) SIGMAR1TMEM97FDPS
SCHEMBL9304202 0.88 SIGMAR1 (0.46) SIGMAR1TMEM97
SCHEMBL9303707 0.86 SCN1A (0.38) SIGMAR1SLC6A4
SCHEMBL9304790 0.79 TAAR1 (0.36) SIGMAR1SLC6A4SLC6A3FDPSTAAR1
SCHEMBL9303673 0.73 CNR2 (0.34) SIGMAR1TMEM97TAAR1
SCHEMBL9303403 0.72 SLC6A2 (0.43) SIGMAR1SLC6A4SLC6A2SLC6A3
SCHEMBL9304060 0.72 KDM4E (0.36) SLC6A4FDPS
SCHEMBL9304467 0.72 UTS2R (0.35) SIGMAR1TMEM97SLC6A9
Hydrochloric Acid SCHEMBL11609001 0.70 SCN1A (0.59) SIGMAR1SLC6A4SLC6A2SLC6A3TMEM97

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-1991009014-A1 MUSCARINIC RECEPTOR ANTAGONISTS PFIZER LIMITED (GB) 1991-06-27 WO disclosed