SCHEMBL28949409

SCHEMBL28949409

C=C(CC(=O)OCC)C(=O)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
MAPT P10636 3/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HPGD P15428 3/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
GAA P10253 2/20 0.42
MGAM O43451 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
PPID Q08752 1/20 0.42
ELANE P08246 1/20 0.42
KDM4E B2RXH2 1/20 0.41
HSP90AA1 P07900 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL11552547 0.89 MAPT (0.52) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL29031679 0.88 ALDH1A1 (0.48) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL2014916 0.85 CYP19A1 (0.45) ALDH1A1MAPTKMT2AHPGDRAB9A
SCHEMBL10709895 0.82 GAA (0.56) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL13554298 0.81 ELANE (0.40) ALDH1A1MAPTMEN1KMT2AELANE
SCHEMBL28781611 0.80 GAA (0.54) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL2346405 0.80 MAPT (0.51) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL28048831 0.80 GAA (0.54) ALDH1A1MAPTMEN1KMT2AHPGD
Ammonia Solution, Strong SCHEMBL27849187 0.80 GAA (0.54) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL434641 0.80 ELANE (0.49) ALDH1A1MAPTKMT2AHPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119931727-A Fuel composition and application thereof 中国石油化工股份有限公司 2025-05-06 CN disclosed
CN-119931726-A Smoke-reducing fuel composition and application thereof 中国石油化工股份有限公司 2025-05-06 CN disclosed
CN-115141663-B Additive for improving lubricating property of gasoline and gasoline composition 中国石油化工股份有限公司 2023-12-12 CN disclosed
CN-115537242-B Diesel antiwear agent composition, preparation method thereof and diesel oil composition 中国石油化工股份有限公司 2023-11-10 CN disclosed
CN-113462443-B Diesel antiwear agent composition, preparation method thereof and diesel oil composition 中国石油化工股份有限公司 2023-07-14 CN disclosed
CN-115537242-A Diesel antiwear agent composition, preparation method thereof and diesel composition 中国石油化工股份有限公司 2022-12-30 CN disclosed
CN-113462443-A Diesel antiwear agent composition, preparation method thereof and diesel composition 中国石油化工股份有限公司 2021-10-01 CN disclosed