SCHEMBL8943455

SCHEMBL8943455

CCCCCCC1(CCCCCC)CC[C@H](O)C(=O)O1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.52
PRKCA P17252 9/20 0.39
GAA P10253 1/20 0.36
PTPN1 P18031 1/20 0.36
ACP1 P24666 1/20 0.36
CDC25B P30305 1/20 0.36
NAAA Q02083 1/20 0.36

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
SCHEMBL8943241 1.00 SIRT2 (0.52) SIRT2PRKCAGAAPTPN1ACP1
SCHEMBL8942837 0.86 SIRT2 (0.36) SIRT2PRKCA
SCHEMBL10802270 0.80 SIRT2 (0.63) SIRT2PRKCAGAA
SCHEMBL4613243 0.74 SIRT2 (0.42) SIRT2PRKCAGAAPTPN1ACP1
SCHEMBL10801235 0.71 SIRT2 (0.83) SIRT2PRKCA
SCHEMBL18134612 0.69 SIRT2 (1.00) SIRT2PRKCAPTPN1ACP1CDC25B
SCHEMBL18134616 0.69 SIRT2 (1.00) SIRT2PRKCAPTPN1ACP1CDC25B
SCHEMBL11220265 0.69 SIRT2 (1.00) SIRT2PRKCAPTPN1ACP1CDC25B
Tanikolide SCHEMBL9902905 0.69 SIRT2 (1.00) SIRT2PRKCAPTPN1ACP1CDC25B
Tanikolide SCHEMBL16432886 0.69 SIRT2 (1.00) SIRT2PRKCAPTPN1ACP1CDC25B

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-0467721-B1 Optically active compound having a delta- valerolactone ring and liquid crystal composition containing same MITSUBISHI RAYON CO (JP) 1996-03-27 EP disclosed
US-5480580-A COMPOUNDS FOR VISUAL AIDS WITH GOOD STABILITY MITSUBISHI RAYON COMPANY LTD. (JP) 1996-01-02 US disclosed
EP-0467721-A1 Optically active compound having a delta- valerolactone ring and liquid crystal composition containing same MITSUBISHI RAYON CO., LTD (JP) 1992-01-22 EP disclosed