SCHEMBL28080449

SCHEMBL28080449

CCCCCCCCCCCCCCCCCC(=O)Oc1cc(C)ccc1C(C)C

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.51
ALDH1A1 P00352 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
NPBWR1 P48145 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MCHR1 Q99705 1/20 0.49
LMNA P02545 1/20 0.48
TOP2A P11388 1/20 0.46

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
SCHEMBL15456833 1.00 ALOX15 (0.51) ALOX15ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL17073977 1.00 ALOX15 (0.51) ALOX15ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL28980175 0.99 ALOX15 (0.52) ALOX15ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL249973 0.94 ALDH1A1 (0.52) ALDH1A1L3MBTL1MEN1KMT2ANPBWR1
SCHEMBL30464896 0.93 LMNA (0.53) ALDH1A1L3MBTL1LMNA
SCHEMBL8006081 0.91 POLM (0.49) ALOX15ALDH1A1L3MBTL1LMNA
SCHEMBL27948943 0.89 LMNA (0.53) ALDH1A1L3MBTL1NPBWR1SMN1; SMN2MCHR1
SCHEMBL248716 0.88 ALDH1A1 (0.53) ALDH1A1L3MBTL1NPBWR1SMN1; SMN2MCHR1
SCHEMBL18256026 0.87 LMNA (0.56) ALDH1A1L3MBTL1LMNA
SCHEMBL30464895 0.87 LMNA (0.56) ALDH1A1L3MBTL1LMNA

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
CN-105707469-A Thymol ester, feed additive and feed 湖南晶天科技实业有限公司 2016-06-29 CN disclosed