SCHEMBL8083744

SCHEMBL8083744

CCC(c1ccc(OCC(C)OCC(C)OCC(C)O)cc1)c1ccc(OCC(C)OCC(C)OCC(C)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
FFAR1 O14842 1/20 0.45
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
GPR88 Q9GZN0 4/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
CYP17A1 P05093 1/20 0.37
CYP2D6 P10635 2/20 0.35
HIF1A Q16665 2/20 0.35
CYP1A2 P05177 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
DRD1 P21728 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
CYP2C19 P33261 1/20 0.35
ADRA1A P35348 1/20 0.35
OPRM1 P35372 1/20 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
SCHEMBL8081870 1.00 LMNA (0.49) LMNAFFAR1ALDH1A1TSHRTDP1
SCHEMBL8078931 0.98 LMNA (0.50) LMNAFFAR1ALDH1A1TSHRTDP1
SCHEMBL7787462 0.87 LMNA (0.63) LMNAFFAR1ALDH1A1TSHRGPR88
SCHEMBL970564 0.82 LMNA (0.72) LMNAALDH1A1TDP1KMT2AMEN1
SCHEMBL1001111 0.82 LMNA (0.72) LMNAALDH1A1TDP1KMT2AMEN1
SCHEMBL2045144 0.81 LMNA (0.50) LMNAALDH1A1TSHRTDP1KMT2A
SCHEMBL872625 0.80 LMNA (0.75) LMNAALDH1A1TDP1KMT2AMEN1
SCHEMBL2049440 0.79 LMNA (0.52) LMNAALDH1A1TSHRTDP1KMT2A
SCHEMBL8083747 0.77 LMNA (0.46) LMNATDP1KMT2ACYP2D6ADRA1A
SCHEMBL2046633 0.77 MAPT (0.47) LMNAALDH1A1TSHRKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6137008-A USEFUL AS STARTING MATERIAL FOR MAKING FLEXIBLE AROMATIC POLYAMIDES OR POLYIMIDES NATIONAL SCIENCE COUNCIL (TW) 2000-10-24 US disclosed
US-5817741-A HEAT RESISTANCE; MELT PROCESSABILITY NATIONAL SCIENCE COUNCIL (TW) 1998-10-06 US disclosed