SCHEMBL16765786

SCHEMBL16765786

CCCCC(C)C1CCCC1(C)O

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 11/20 0.42
CDC25B P30305 9/20 0.42
EBP Q15125 2/20 0.36
GPBAR1 Q8TDU6 5/20 0.34
NR1H4 Q96RI1 3/20 0.33

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
SCHEMBL16766758 0.89 CDC25A (0.38) CDC25ACDC25BEBPGPBAR1NR1H4
SCHEMBL16766348 0.82 CDC25A (0.33) CDC25ACDC25B
SCHEMBL16766104 0.81 CDC25A (0.38) CDC25ACDC25BEBPGPBAR1
SCHEMBL16766344 0.78 CDC25A (0.39) CDC25ACDC25BEBPGPBAR1NR1H4
SCHEMBL11146731 0.77 GPBAR1 (0.32) GPBAR1NR1H4
SCHEMBL16766221 0.77 CDC25A (0.36) CDC25ACDC25B
SCHEMBL16766101 0.74
SCHEMBL16383069 0.73 L3MBTL1 (0.34) CDC25ACDC25B
SCHEMBL21948078 0.73 L3MBTL1 (0.34) CDC25ACDC25B
SCHEMBL21948079 0.73 L3MBTL1 (0.34) CDC25ACDC25B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104710283-B Cyclopentanol compound 国际香料和香精公司 2019-06-11 CN disclosed
US-9701925-B2 Cyclopentanol compounds INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2017-07-11 US disclosed
US-20160160152-A1 NOVEL CYCLOPENTANOL COMPOUNDS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2016-06-09 US disclosed
US-9290718-B2 Cyclopentanol compounds INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2016-03-22 US disclosed
EP-2902468-A2 Novel cyclopentanol compounds International Flavors & Fragrances Inc. (US) 2015-08-05 EP disclosed
CN-104710283-A Novel cyclopentanol compounds INT FLAVORS & FRAGRANCES INC 2015-06-17 CN disclosed
US-20150159118-A1 NOVEL CYCLOPENTANOL COMPOUNDS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2015-06-11 US disclosed