SCHEMBL28580833

SCHEMBL28580833

CCCCCCCCCC1OCC(CO)(CO)CO1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
EPHX1 P07099 1/20 0.41
PRKCA P17252 7/20 0.40
PRKD3 O94806 2/20 0.40
PRKCG P05129 2/20 0.40
PRKCB P05771 2/20 0.40
PRKCH P24723 2/20 0.40
PRKCI P41743 2/20 0.40
PRKCE Q02156 2/20 0.40
PRKCQ Q04759 2/20 0.40
PRKCZ Q05513 2/20 0.40
PRKCD Q05655 2/20 0.40
PRKD1 Q15139 2/20 0.40
SPHK2 Q9NRA0 3/20 0.38
SPHK1 Q9NYA1 3/20 0.38
ENPP2 Q13822 4/20 0.35
LPAR2 Q9HBW0 3/20 0.35
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL28213403 1.00 ALDH1A1 (0.48) ALDH1A1EPHX1PRKCAPRKD3PRKCG
SCHEMBL28585195 0.98 ALDH1A1 (0.45) ALDH1A1EPHX1PRKCAPRKD3PRKCG
SCHEMBL28213812 0.92 ALDH1A1 (0.38) ALDH1A1EPHX1PRKCAPRKD3PRKCG
SCHEMBL9619415 0.85 ALDH1A1 (0.35) ALDH1A1EPHX1PRKCAPRKD3PRKCG
SCHEMBL28283512 0.84 EPHX1 (0.34) EPHX1
SCHEMBL8978109 0.82 ALDH1A1 (0.46) ALDH1A1EPHX1PRKCAPRKD3PRKCG
SCHEMBL31008720 0.81 EPHX1 (0.32) EPHX1
SCHEMBL1470315 0.80 ALDH1A1 (0.56) ALDH1A1EPHX1PRKCAPRKD3PRKCG
SCHEMBL1469745 0.80 ALDH1A1 (0.56) ALDH1A1EPHX1PRKCAPRKD3PRKCG
SCHEMBL1470343 0.80 ALDH1A1 (0.56) ALDH1A1EPHX1PRKCAPRKD3PRKCG

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
CN-108003896-B Liquid crystal alignment agent, liquid crystal alignment film and liquid crystal display element 奇美实业股份有限公司 2022-10-21 CN disclosed
CN-108003614-B Composition for flexible substrate, method for producing same, and flexible substrate 奇美实业股份有限公司 2021-06-29 CN disclosed