SCHEMBL7057716

SCHEMBL7057716

CN(CCC(C)(C)COCC(C)(C)CCN(C)Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.51
PRMT6 Q96LA8 1/20 0.51
PRMT8 Q9NR22 1/20 0.51
SIGMAR1 Q99720 1/20 0.47
TSHR P16473 4/20 0.45
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 3/20 0.42
HTR1D P28221 1/20 0.42
HTR1B P28222 1/20 0.42
MAOB P27338 2/20 0.42
USP2 O75604 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAOA P21397 1/20 0.42
PYCR1 P32322 1/20 0.42
BLM P54132 1/20 0.41

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
SCHEMBL7057713 0.81 CARM1 (0.53) CARM1PRMT6PRMT8SIGMAR1TSHR
SCHEMBL16247246 0.80 CARM1 (0.60) CARM1PRMT6PRMT8SIGMAR1TSHR
SCHEMBL4478771 0.77 CARM1 (0.56) CARM1PRMT6PRMT8SIGMAR1TSHR
SCHEMBL7055109 0.75 CARM1 (0.75) CARM1PRMT6PRMT8SIGMAR1TSHR
SCHEMBL16039984 0.73 CARM1 (0.51) CARM1PRMT6PRMT8SIGMAR1SMN1; SMN2
SCHEMBL20097978 0.73 CARM1 (0.56) CARM1PRMT6PRMT8SIGMAR1TSHR
SCHEMBL13887762 0.72 TSHR (0.55) CARM1PRMT6PRMT8SIGMAR1TSHR
SCHEMBL1088446 0.72 SIGMAR1 (0.74) CARM1PRMT6PRMT8SIGMAR1TSHR
SCHEMBL16219418 0.72 CARM1 (0.58) CARM1PRMT6PRMT8SIGMAR1TSHR
SCHEMBL27376506 0.71 CARM1 (0.45) CARM1PRMT6PRMT8SIGMAR1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0955806-B1 BIOACTIVE COMPOUNDS US AGRICULTURE (US) 2003-05-14 EP claimed
EP-0955806-A4 BIOACTIVE COMPOUNDS US AGRICULTURE (US) 2000-05-31 EP claimed
EP-0955806-A1 BIOACTIVE COMPOUNDS THE UNITED STATES OF AMERICA as represented by THE SECRETARY OF AGRICULTURE (US) 1999-11-17 EP claimed
WO-1997031529-A1 BIOACTIVE COMPOUNDS THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1997-09-04 WO claimed
EP-0955806-B1 BIOACTIVE COMPOUNDS US AGRICULTURE (US) 2003-05-14 EP disclosed
EP-0955806-A4 BIOACTIVE COMPOUNDS US AGRICULTURE (US) 2000-05-31 EP disclosed
EP-0955806-A1 BIOACTIVE COMPOUNDS THE UNITED STATES OF AMERICA as represented by THE SECRETARY OF AGRICULTURE (US) 1999-11-17 EP disclosed
WO-1997031529-A1 BIOACTIVE COMPOUNDS THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1997-09-04 WO disclosed