SCHEMBL3837864

SCHEMBL3837864

NC1CC(N)CC(N)(CC(=O)O)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
SLC6A12 P48065 3/20 0.37
SLC6A11 P48066 3/20 0.37
SLC6A13 Q9NSD5 3/20 0.37
ARG1 P05089 1/20 0.37
ARG2 P78540 1/20 0.37
GRM2 Q14416 2/20 0.36
GRM5 P41594 1/20 0.36
GRM1 Q13255 1/20 0.36
ALDH1A1 P00352 5/20 0.32
CYP1A2 P05177 4/20 0.32
TSHR P16473 2/20 0.32
CYP2C9 P11712 2/20 0.32
HSD11B1 P28845 1/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
BLM P54132 1/20 0.32
CACNA2D1 P54289 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
THRB P10828 1/20 0.32

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
SCHEMBL1764007 0.74 CYP1A2 (0.36) POLBSLC6A12SLC6A11SLC6A13GRM2
SCHEMBL27618639 0.72 POLB (0.38) POLBGRM2GRM5GRM1ALDH1A1
SCHEMBL27618524 0.71 POLB (0.37) POLBGRM2GRM5GRM1ALDH1A1
SCHEMBL27637708 0.71 POLB (0.37) POLBGRM2GRM5GRM1ALDH1A1
SCHEMBL4115624 0.71
SCHEMBL28862617 0.70 GRM4 (0.56) ARG1ARG2GRM2GRM5GRM1
Hydrochloric Acid SCHEMBL16666607 0.69
SCHEMBL430341 0.67
SCHEMBL289131 0.67 CYP1A2 (0.52) POLBGRM1ALDH1A1CYP1A2TSHR
Hydrochloric Acid SCHEMBL3705397 0.65 CYP1A2 (0.50) POLBGRM1ALDH1A1CYP1A2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1650214-B1 Silicon compound CHISSO CORP (JP) 2009-11-04 EP disclosed
US-7375170-B2 Organosilicon compound CHISSO CORPORATION (JP) 2008-05-20 US disclosed
EP-1849787-A1 Organosilicon compound Chisso Corporation (JP) 2007-10-31 EP disclosed
EP-1849788-A1 Organosilicon compound Chisso Corporation (JP) 2007-10-31 EP disclosed
US-7256243-B2 Silicon compound CHISSO CORPORATION (JP) 2007-08-14 US disclosed
US-20060175684-A1 Organosilicon compound JNC PETROCHEMICAL CORPORATION (JP) 2006-08-10 US disclosed
EP-1686133-A2 Organosilicon compound CHISSO CORPORATION (JP) 2006-08-02 EP disclosed
EP-1650214-A2 Silicon compound CHISSO CORPORATION (JP) 2006-04-26 EP disclosed
US-20050250925-A1 Silicon compound JNC CORPORATION (JP) 2005-11-10 US disclosed