SCHEMBL4299871

SCHEMBL4299871

C=CC(=O)Oc1ccccc1C1CCC(CCC)CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.47
THRA P10827 1/20 0.47
CYP2C9 P11712 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
SSTR4 P31391 3/20 0.38
SSTR1 P30872 2/20 0.38
DRD2 P14416 1/20 0.38
HTT P42858 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
HTR1D P28221 2/20 0.36
HTR1B P28222 2/20 0.36
CHRM4 P08173 1/20 0.35
MAPK1 P28482 1/20 0.34

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
SCHEMBL11403403 0.82 LMNA (0.51) CYP2C9ALDH1A1MAPTLMNAPTGDR2
SCHEMBL20615578 0.82 CYP2C9 (0.39) THRBTHRACYP2C9ALDH1A1MAPT
SCHEMBL2582813 0.80 PTGDR2 (0.55) THRBTHRACYP2C9PTGDR2MEN1
SCHEMBL74879 0.78 CYP2C9 (0.57) THRBTHRACYP2C9ALDH1A1MAPT
SCHEMBL1655552 0.78 CYP2C9 (0.57) THRBTHRACYP2C9ALDH1A1MAPT
SCHEMBL9810929 0.77 DRD2 (0.60) DRD2MEN1KMT2A
SCHEMBL9810931 0.76 HTR1D (0.48) THRBCYP2C9ALDH1A1MAPTLMNA
SCHEMBL74271 0.75 CYP2C9 (0.53) THRBTHRACYP2C9ALDH1A1MAPT
SCHEMBL12386500 0.75 CYP2C9 (0.53) THRBCYP2C9ALDH1A1MAPTLMNA
SCHEMBL3361040 0.75 THRB (0.53) THRBTHRACYP2C9MAPTHTT

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
US-20090147200-A1 VERTICAL ALIGNMENT FILM AND METHOD OF MANUFACTURING THEREOF, VERTICAL ALIGNMENT SUBSTRATE AND METHOD OF MANUFACTURING THEREOF, AND LIQUID CRYSTAL DISPLAY DEVICE SONY CORPORATION (JP) 2009-06-11 US disclosed