SCHEMBL9812686

SCHEMBL9812686

CCCCCCCCCCCCN1C=CC(N(C)C)=CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.36
PTGS2 P35354 3/20 0.36
MGLL Q99685 3/20 0.36
FAAH O00519 1/20 0.36
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
GRM2 Q14416 1/20 0.32
KCNH2 Q12809 1/20 0.31
NPC1 O15118 6/20 0.30
RAB9A P51151 6/20 0.30
HTT P42858 4/20 0.30
GALR3 O60755 2/20 0.30
POLB P06746 2/20 0.30
ATM Q13315 2/20 0.30
MAPK1 P28482 2/20 0.30
NPSR1 Q6W5P4 2/20 0.30
LMNA P02545 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30

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
SCHEMBL27836614 1.00 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL9812701 1.00 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL9812725 0.93 GRM2 (0.35) GRM2
Water SCHEMBL28757012 0.92 GRM2 (0.34) GRM2
Hydrochloric Acid SCHEMBL28009755 0.92 GRM2 (0.34) GRM2
SCHEMBL27703879 0.86
SCHEMBL11291370 0.80 PTGS1 (0.40) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL5795034 0.79
SCHEMBL27696873 0.78 MGLL (0.39) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL27683092 0.78 MGLL (0.39) PTGS1PTGS2MGLLFAAHALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4933469-A Method for preparing oxybisphthalimides GENERAL ELECTRIC COMPANY (US) 1990-06-12 US claimed
EP-0126950-B1 METHOD FOR MAKING AROMATIC ETHERS AND CATALYST USED IN SUCH METHOD GENERAL ELECTRIC COMPANY (US) 1991-07-31 EP disclosed
US-4933469-A Method for preparing oxybisphthalimides GENERAL ELECTRIC COMPANY (US) 1990-06-12 US disclosed
US-4605745-A PHASE TRANSFER CATALYSTS; AROMATIC ETHERS IN IMPROVED YIELDS GENERAL ELECTRIC COMPANY (US) 1986-08-12 US disclosed
US-4513141-A BY DISPLACING REACTIVE RADICALS ON AROMATIC NUCLEUS GENERAL ELECTRIC COMPANY (US) 1985-04-23 US disclosed
EP-0126950-A2 Method for making aromatic ethers and catalyst used in such method GENERAL ELECTRIC COMPANY (US) 1984-12-05 EP disclosed