SCHEMBL9853458

SCHEMBL9853458

COC(=O)C12CCC(C)N1C(C)CC2

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.36
NPSR1 Q6W5P4 1/20 0.34
MAPT P10636 1/20 0.33
HRH3 Q9Y5N1 1/20 0.31

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
SCHEMBL9853457 0.77 MAPT (0.31) MAPT
SCHEMBL16771549 0.77 NPSR1 (0.33) LMNATSHRNPSR1MAPTHRH3
SCHEMBL9853470 0.75 EPHX1 (0.30) MAPT
SCHEMBL25555185 0.74 TSHR (0.33) TSHR
SCHEMBL24894338 0.72 ATM (0.31)
SCHEMBL20221547 0.72 NPSR1 (0.34) LMNANPSR1MAPT
SCHEMBL29239801 0.72 OPRM1 (0.35) LMNA
SCHEMBL4179515 0.69 SLC6A9 (0.36) NPSR1MAPT
SCHEMBL4876100 0.69 NPSR1 (0.32) TSHRNPSR1MAPT
SCHEMBL2125006 0.68 NPSR1 (0.32) NPSR1MAPT

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-0431605-A2 1-Azabicyclo[m.n.O]alkane derivatives, their salts and process for preparing them SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1991-06-12 EP disclosed