SCHEMBL9810867

SCHEMBL9810867

CC(Cc1cccc(O)c1)CN1CC(C)OC(C)C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EBP Q15125 1/20 0.57
SIGMAR1 Q99720 1/20 0.57
ADORA3 P0DMS8 1/20 0.54
CHRM1 P11229 1/20 0.54
DRD3 P35462 1/20 0.54
KCNH2 Q12809 1/20 0.54
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
MAPK1 P28482 2/20 0.42
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL9850406 0.83 SIGMAR1 (0.71) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL4454620 0.83 EBP (0.70) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL14146050 0.83 EBP (0.70) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL11927701 0.83 EBP (0.70) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL11927700 0.83 EBP (0.70) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL4454622 0.83 EBP (0.70) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL6345394 0.82 SIGMAR1 (0.73) EBPSIGMAR1ADORA3CHRM1DRD3
Hydrochloric Acid SCHEMBL28017968 0.82 EBP (0.68) EBPSIGMAR1ADORA3CHRM1DRD3
Hydrochloric Acid SCHEMBL28469297 0.82 EBP (0.68) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9845765 0.81 EBP (0.51) EBPSIGMAR1ADORA3CHRM1DRD3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0262870-B1 MORPHOLINE, PIPERIDINE AND TETRAHYDROPYRIDINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-06-12 EP disclosed
EP-0405440-A1 Microbicides CIBA-GEIGY AG (CH) 1991-01-02 EP disclosed
US-4837236-A CONTROLLING PHYTOPATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-06-06 US disclosed
EP-0262870-A2 Morpholine, piperidine and tetrahydropyridine derivatives, processes for their preparation and their use as fungicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-04-06 EP disclosed