SCHEMBL4973202

SCHEMBL4973202

BrC1C2CCC1N(CCc1ccccc1)C2

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.45
GAA P10253 1/20 0.42
SIGMAR1 Q99720 1/20 0.41
ACHE P22303 1/20 0.41
GBA1 P04062 1/20 0.40
CCR3 P51677 1/20 0.40

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
SCHEMBL4180052 1.00 HRH3 (0.45) HRH3GAASIGMAR1ACHEGBA1
SCHEMBL4190627 0.84 ROCK2 (0.44)
SCHEMBL7003079 0.66 SLC6A3 (0.61) HRH3SIGMAR1ACHEGBA1CCR3
SCHEMBL7692425 0.66 SLC18A2 (0.56) HRH3GAASIGMAR1
SCHEMBL7695964 0.66 SLC18A2 (0.56) HRH3GAASIGMAR1
SCHEMBL24493725 0.66 ACHE (0.51) HRH3GAASIGMAR1ACHE
SCHEMBL7383573 0.65 HRH3 (0.58) HRH3SIGMAR1ACHEGBA1CCR3
SCHEMBL7385498 0.65 HRH3 (0.58) HRH3SIGMAR1ACHEGBA1CCR3
SCHEMBL5375336 0.65 GAA (0.59) HRH3GAASIGMAR1GBA1
SCHEMBL5556346 0.65 GAA (0.59) HRH3GAASIGMAR1GBA1

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-1968980-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES, LTD. (IN) 2008-09-17 EP disclosed
WO-2007110782-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-10-04 WO disclosed