SCHEMBL10353371

SCHEMBL10353371

CCCCOCCOCCOC(C)OC(C)OCCOCCOCCCC

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
CYP3A4 P08684 2/20 0.43
MAPT P10636 2/20 0.40
HTT P42858 2/20 0.40
MEN1 O00255 1/20 0.40
THRB P10828 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SPHK1 Q9NYA1 1/20 0.32
USP2 O75604 1/20 0.31
RARB P10826 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
CES1 P23141 1/20 0.31

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
SCHEMBL9137911 0.91 TSHR (0.48) TSHRCYP3A4MAPTHTTMEN1
SCHEMBL6122979 0.85 ADRB2 (0.39) TSHRCYP3A4SMN1; SMN2ADRB2ADRB1
SCHEMBL11433643 0.84 TSHR (0.43) TSHRCYP3A4MAPTHTTMEN1
SCHEMBL9137918 0.83 ADRB2 (0.38) TSHRCYP3A4SMN1; SMN2ADRB2ADRB1
SCHEMBL10353370 0.83 ADRB2 (0.38) TSHRCYP3A4SMN1; SMN2ADRB2ADRB1
SCHEMBL15820283 0.82 TSHR (0.44) TSHRCYP3A4MAPTHTTMEN1
SCHEMBL4838940 0.81 TSHR (0.48) TSHRCYP3A4MAPTHTTMEN1
SCHEMBL3419111 0.81 TSHR (0.48) TSHRCYP3A4MAPTHTTMEN1
SCHEMBL20825331 0.81 TSHR (0.48) TSHRCYP3A4MAPTHTTMEN1
SCHEMBL7585280 0.81 TSHR (0.48) TSHRCYP3A4MAPTHTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0279426-B1 OPTICAL RECORDING MEMBER MITSUBISHI KASEI CORPORATION (JP) 1990-09-26 EP disclosed
US-4904567-A Optical recording member MITSUBISHI KASEI CORPORATION (JP) 1990-02-27 US disclosed
EP-0279426-A2 Optical recording member MITSUBISHI KASEI CORPORATION (JP) 1988-08-24 EP disclosed