SCHEMBL9164899

SCHEMBL9164899

CC(Cc1ccc(OC[Si](C)(C)C)cc1)CN1CC(C)OC(C)C1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EBP Q15125 1/20 0.64
SIGMAR1 Q99720 1/20 0.64
ADORA3 P0DMS8 1/20 0.60
CHRM1 P11229 1/20 0.60
DRD3 P35462 1/20 0.60
KCNH2 Q12809 1/20 0.60
MAPK1 P28482 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
KDM4E B2RXH2 8/20 0.42
POLB P06746 1/20 0.42
TDP1 Q9NUW8 2/20 0.42
ALDH1A1 P00352 8/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
HTT P42858 2/20 0.39
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL9164585 0.87 EBP (0.52) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL11346414 0.86 EBP (0.67) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9162747 0.85 EBP (0.62) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9161151 0.84 EBP (0.58) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9862828 0.84 EBP (0.60) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL11462886 0.83 SIGMAR1 (0.74) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9815028 0.83 SIGMAR1 (0.70) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9124698 0.83 MAPK1 (0.54) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL9162509 0.83 SIGMAR1 (0.66) EBPSIGMAR1ADORA3CHRM1DRD3
SCHEMBL10929087 0.82 SIGMAR1 (0.69) 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
US-5314879-A Agriculture Ministero Delli `Universita` E Della Ricerca Scientifica E Tecnologica (IT) 1994-05-24 US claimed
EP-0444706-A2 Aryl-propyl-amines having antifungal activity MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 1991-09-04 EP claimed
US-5378707-A Applying to Erysiphe and/or Helminthosporium; agriculture MINESTERO DELL' UNIVERSITA 'E DELLA RICERCA SCIENTIFICA E TECHNOLOGICA (IT) 1995-01-03 US disclosed
EP-0444706-A2 Aryl-propyl-amines having antifungal activity MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 1991-09-04 EP disclosed