SCHEMBL25322374

SCHEMBL25322374

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

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.63
LMNA P02545 2/20 0.62
POLB P06746 1/20 0.62
MGLL Q99685 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HTT P42858 1/20 0.43

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
SCHEMBL1069423 0.88 LMNA (0.62) ALDH1A1LMNAPOLBMGLLNPSR1
SCHEMBL27761826 0.87 LMNA (0.74) ALDH1A1LMNAPOLBMGLLNPSR1
SCHEMBL4947324 0.84 LMNA (0.71) ALDH1A1LMNAPOLBMGLL
SCHEMBL9782283 0.82 ALDH1A1 (0.59) ALDH1A1LMNAPOLBMGLLNPSR1
SCHEMBL394803 0.82 ALDH1A1 (0.53) ALDH1A1MGLL
SCHEMBL10713472 0.81 LMNA (0.66) ALDH1A1LMNAPOLBMGLLNPSR1
SCHEMBL30938433 0.81 LMNA (0.66) ALDH1A1LMNAPOLBMGLLNPSR1
SCHEMBL30938434 0.81 LMNA (0.66) ALDH1A1LMNAPOLBMGLLNPSR1
SCHEMBL8715408 0.80 LMNA (0.70) ALDH1A1LMNAPOLBMGLLNPSR1
SCHEMBL11078719 0.80 ALDH1A1 (0.57) ALDH1A1LMNAPOLBMGLLNPSR1

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
WO-2023145634-A1 ANTIFOULING COATING MATERIAL COMPOSITION 日東化成株式会社 2023-08-03 WO disclosed