SCHEMBL28066382

SCHEMBL28066382

CC(=O)OC=C=CCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.37
HPGD P15428 1/20 0.37
MAOB P27338 2/20 0.36
LMNA P02545 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
TOP1 P11387 1/20 0.35
PTGS2 P35354 1/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
AKR1B1 P15121 1/20 0.34
TSHR P16473 1/20 0.34
CYP2C9 P11712 1/20 0.34
GAA P10253 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
SCHEMBL3247823 0.77 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2HPGDMAOBLMNA
SCHEMBL990789 0.76 PAM (0.45) ALDH1A1SMN1; SMN2MAOBLMNANPC1
SCHEMBL3359398 0.74 MAOB (0.50) ALDH1A1SMN1; SMN2HPGDMAOBLMNA
SCHEMBL3359392 0.74 MAOB (0.50) ALDH1A1SMN1; SMN2HPGDMAOBLMNA
SCHEMBL4254918 0.74 MAOB (0.50) ALDH1A1SMN1; SMN2HPGDMAOBLMNA
Allylbenzene SCHEMBL28273138 0.71 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2MAOBPTGS2TSHR
SCHEMBL6719368 0.71 ALDH1A1 (0.33) ALDH1A1
SCHEMBL9065189 0.71
SCHEMBL29054488 0.70 MAOB (0.48) ALDH1A1MAOBTSHR
SCHEMBL27962977 0.70

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-103992828-B There is lubricated wear-resistant diesel oil starting protection additive QUANZHOU CITY OUMEI LUBRICANT PRODUCTS CO., LTD. (CN) 2016-05-18 CN disclosed