SCHEMBL9569072

SCHEMBL9569072

CC(CO)CCC(O)C(O)CCO

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
THRB P10828 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33
LMNA P02545 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL19327340 0.86 TSHR (0.46) TSHRTHRBTDP1ALDH1A1ALOX15
SCHEMBL4154359 0.82 TSHR (0.46) TSHRTHRBTDP1ALDH1A1ALOX15
SCHEMBL8608515 0.81 TSHR (0.50) TSHRTDP1LMNAL3MBTL1
SCHEMBL10686177 0.80 TSHR (0.55) TSHRTHRBTDP1ALDH1A1ALOX15
SCHEMBL794539 0.80
SCHEMBL111181 0.80
SCHEMBL2499904 0.80
SCHEMBL14113732 0.80 TSHR (0.69) TSHRTHRBTDP1ALDH1A1ALOX15
SCHEMBL168774 0.80 TSHR (0.69) TSHRTHRBTDP1ALDH1A1ALOX15
Methyl Alcohol SCHEMBL25212727 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0550407-A2 Synthetic lubricating oils NIPPON OIL Co. Ltd. (JP) 1993-07-07 EP disclosed
EP-0548049-A2 Synthetic lubricating oils NIPPON OIL Co. Ltd. (JP) 1993-06-23 EP disclosed