SCHEMBL28113715

SCHEMBL28113715

OCCCC(CO)CO.OCCCCCCCCCO

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
ALDH1A1 P00352 2/20 0.42
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 1/20 0.38
GPR84 Q9NQS5 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
THRB P10828 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
1,5-Pentanediol SCHEMBL484475 1.00 LMNA (0.48) LMNAALDH1A1HSD17B10MEN1KMT2A
1,4-Butanediol SCHEMBL11552182 0.97 LMNA (0.43) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL11690155 0.94 LMNA (0.55) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL9099634 0.94 LMNA (0.55) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL2112474 0.94 LMNA (0.55) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL9099182 0.94 LMNA (0.55) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL9097489 0.94 LMNA (0.55) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL9862682 0.94 LMNA (0.55) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL272442 0.94 LMNA (0.55) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL263657 0.94 LMNA (0.55) LMNAALDH1A1HSD17B10MEN1KMT2A

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-106317369-A Aqueous polyurethane resin dispersion and use thereof 宇部兴产株式会社 2017-01-11 CN disclosed