SCHEMBL2773470

SCHEMBL2773470

C=CCOC(=O)CCCCC(=O)OC=C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.67
▸ ALDH1A1 P00352 5/20 0.47
▸ GAA P10253 1/20 0.47
▸ EPHX2 P34913 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ PKM P14618 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ CYP3A4 P08684 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ DGKA P23743 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ CACNA1B Q00975 1/20 0.35
▸ APBA1 Q02410 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ PAM P19021 2/20 0.33
▸ ABCC4 O15439 1/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ CYP1A2 P05177 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32

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
SCHEMBL2773868 0.98 TSHR (0.70) TSHRALDH1A1GAAEPHX2SMN1; SMN2
SCHEMBL153651 0.91 TSHR (0.77) TSHRALDH1A1GAAEPHX2SMN1; SMN2
SCHEMBL11131759 0.89 TSHR (0.74) TSHRALDH1A1GAAEPHX2SMN1; SMN2
SCHEMBL10834721 0.89 TSHR (0.81) TSHRALDH1A1GAAEPHX2SMN1; SMN2
SCHEMBL632341 0.89 TSHR (0.81) TSHRALDH1A1GAAEPHX2SMN1; SMN2
SCHEMBL5392962 0.89 TSHR (0.81) TSHRALDH1A1GAAEPHX2SMN1; SMN2
SCHEMBL180289 0.89 TSHR (0.81) TSHRALDH1A1GAAEPHX2SMN1; SMN2
SCHEMBL11795597 0.89 TSHR (0.81) TSHRALDH1A1GAAEPHX2SMN1; SMN2
SCHEMBL3120781 0.89 TSHR (0.81) TSHRALDH1A1GAAEPHX2SMN1; SMN2
SCHEMBL463195 0.87 TSHR (0.70) TSHRALDH1A1GAAEPHX2SMN1; SMN2

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
EP-2174966-A1 OPTICAL MATERIAL AND OPHTHALMIC LENS MADE OF THE SAME Menicon Co., Ltd. (JP) 2010-04-14 — — EP disclosed
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