SCHEMBL9678342

SCHEMBL9678342

OCCC1C2CCC1N(Cc1ccccc1)C2

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.45
ROCK2 O75116 1/20 0.43
ARHGDIA P52565 1/20 0.43
ROCK1 Q13464 1/20 0.43
MAPT P10636 1/20 0.42
POLB P06746 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
GBA1 P04062 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
SCHEMBL5833283 0.88 GBA1 (0.46) ROCK2ARHGDIAROCK1MAPTGBA1
SCHEMBL5833930 0.83 ROCK2 (0.42) ROCK2ARHGDIAROCK1MAPT
SCHEMBL6180409 0.82 KDM4E (0.44) ROCK2ARHGDIAROCK1MAPT
SCHEMBL5833647 0.82 ROCK2 (0.45) ROCK2ARHGDIAROCK1MAPT
SCHEMBL4966861 0.78 MAPT (0.50) SIGMAR1ROCK2ARHGDIAROCK1MAPT
SCHEMBL6545137 0.78 SIGMAR1 (0.44) SIGMAR1ROCK2ARHGDIAROCK1MAPT
Hydrochloric Acid SCHEMBL6707460 0.77 SIGMAR1 (0.43) SIGMAR1ROCK2ARHGDIAROCK1MAPT
SCHEMBL5833935 0.76 ROCK2 (0.41) SIGMAR1ROCK2ARHGDIAROCK1MAPT
SCHEMBL5833927 0.76 ROCK2 (0.43) SIGMAR1ROCK2ARHGDIAROCK1MAPT
SCHEMBL6180405 0.76 MTNR1A (0.47) ROCK2ARHGDIAROCK1MAPTALDH1A1

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
EP-0510129-A1 MUSCARINIC RECEPTOR ANTAGONISTS Pfizer Limited (GB) 1992-10-28 EP disclosed