SCHEMBL10582736

SCHEMBL10582736

CC1CN(CCCCl)CC(C)O1.[MgH2]

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.60
EBP Q15125 1/20 0.60
KDM4E B2RXH2 8/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 6/20 0.41
KMT2A Q03164 2/20 0.41
HTT P42858 2/20 0.41
TSHR P16473 1/20 0.41
ATM Q13315 1/20 0.41
GAA P10253 1/20 0.41
POLB P06746 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
MEN1 O00255 1/20 0.39

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
SCHEMBL9449653 0.98 SIGMAR1 (0.62) SIGMAR1EBPKDM4ELMNAALDH1A1
SCHEMBL16322104 0.98 SIGMAR1 (0.62) SIGMAR1EBPKDM4ELMNAALDH1A1
Hydrochloric Acid SCHEMBL9449875 0.90 SIGMAR1 (0.63) SIGMAR1EBPKDM4ELMNAALDH1A1
SCHEMBL9449755 0.90 SIGMAR1 (0.69) SIGMAR1EBPKDM4ELMNAALDH1A1
SCHEMBL15210850 0.85 SIGMAR1 (0.55) SIGMAR1EBPKDM4ELMNAALDH1A1
SCHEMBL9449643 0.85 SIGMAR1 (0.55) SIGMAR1EBPKDM4ELMNAALDH1A1
Hydrochloric Acid SCHEMBL2959127 0.83 SIGMAR1 (0.53) SIGMAR1EBPKDM4ELMNAALDH1A1
Hydrochloric Acid SCHEMBL5369449 0.83 SIGMAR1 (0.53) SIGMAR1EBPKDM4ELMNAALDH1A1
Hydrochloric Acid SCHEMBL11412105 0.80 SIGMAR1 (0.67) SIGMAR1EBPKDM4ELMNAALDH1A1
SCHEMBL8283672 0.78 SIGMAR1 (0.84) SIGMAR1EBPKDM4ELMNAALDH1A1

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
CN-1079610-A Plant fungicide compositions DOW CHEMICAL CO (US) 1993-12-22 CN disclosed
CN-1022838-C Morpholinyl silanes, process for their preparation and their use DOW CHEMICAL CO (US) 1993-11-24 CN disclosed
CN-1040028-A Morpholinyl silanes, process for their preparation and their use DOW CHEMICAL CO (US) 1990-02-28 CN disclosed
EP-0313353-A1 Morpholinyl silanes and use for control of plant diseases caused by fungi DOWELANCO (US) 1989-04-26 EP disclosed