SCHEMBL29199876

SCHEMBL29199876

C=C(O)C(=O)OCC1CCCO1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.59
LMNA P02545 2/20 0.58
POLB P06746 1/20 0.58
NPSR1 Q6W5P4 1/20 0.48
HTT P42858 1/20 0.42
MGLL Q99685 2/20 0.42

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
SCHEMBL5078328 0.85 LMNA (0.57) ALDH1A1LMNAPOLBNPSR1HTT
SCHEMBL36133 0.85 ALDH1A1 (0.67) ALDH1A1LMNAPOLBNPSR1
SCHEMBL27848264 0.85 ALDH1A1 (0.67) ALDH1A1LMNAPOLBNPSR1
Methacrylic Acid SCHEMBL5309818 0.84 ALDH1A1 (0.61) ALDH1A1LMNAPOLBNPSR1
SCHEMBL11078719 0.84 ALDH1A1 (0.57) ALDH1A1LMNAPOLBNPSR1HTT
SCHEMBL14994236 0.83 LMNA (0.55) ALDH1A1LMNAPOLBNPSR1
SCHEMBL28309955 0.83 ALDH1A1 (0.65) ALDH1A1LMNAPOLBNPSR1
SCHEMBL26129285 0.83 LMNA (0.55) ALDH1A1LMNAPOLBNPSR1
SCHEMBL9782283 0.83 ALDH1A1 (0.59) ALDH1A1LMNAPOLBNPSR1HTT
SCHEMBL1069423 0.82 LMNA (0.62) ALDH1A1LMNAPOLBNPSR1MGLL

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-117946548-A Inkjet ink composition, ink set, recording method, and recording apparatus 精工爱普生株式会社 2024-04-30 CN disclosed