SCHEMBL7199377

SCHEMBL7199377

CC(Nc1c(C)cccc1C)=C1C=CC=CN1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
ALDH1A1 P00352 4/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
GRIN3A Q8TCU5 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C9 P11712 2/20 0.36
NFKB1 P19838 1/20 0.36
CYP2C19 P33261 1/20 0.36
GAA P10253 2/20 0.35
POLB P06746 3/20 0.35
MAPT P10636 3/20 0.35

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
SCHEMBL19686162 0.67
SCHEMBL7196802 0.67 GRIN2D (0.37) LMNAALDH1A1L3MBTL1GRIN2DGRIN3B
SCHEMBL7196800 0.67 GRIN2D (0.37) LMNAALDH1A1L3MBTL1GRIN2DGRIN3B
SCHEMBL1743188 0.66 GRIN2D (0.55) LMNAALDH1A1L3MBTL1GRIN2DGRIN3B
Hydrochloric Acid SCHEMBL11247930 0.65 GRIN2D (0.53) LMNAALDH1A1L3MBTL1GRIN2DGRIN3B
SCHEMBL12627891 0.64 LMNA (0.52) LMNAALDH1A1L3MBTL1GRIN2DGRIN3B
SCHEMBL19573921 0.64 ALDH1A1 (0.47) LMNAALDH1A1L3MBTL1GRIN2DGRIN3B
SCHEMBL436967 0.64 ALDH1A1 (0.59) LMNAALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL9168588 0.62 ALDH1A1 (0.57) LMNAALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL14075880 0.62 NPC1 (0.39) GAA

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
WO-2004074333-A2 PROCESS FOR HOMO- OR COPOLYMERIZATIONOF CONJUGATED OLEFINES DOW GLOBAL TECHNOLOGIES INC. (US) 2004-09-02 WO disclosed