SCHEMBL24627009

SCHEMBL24627009

CCCC(C)N(C)CC=O

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL26316946 0.81
SCHEMBL29950565 0.78 ALDH1A1 (0.39) ALDH1A1
SCHEMBL19071525 0.76
SCHEMBL25914989 0.75 CHRNB2 (0.32)
SCHEMBL5948230 0.72
SCHEMBL3937939 0.72
SCHEMBL270914 0.71
SCHEMBL13663057 0.70 TSHR (0.32)
SCHEMBL29952747 0.70 MAOB (0.30)
SCHEMBL277071 0.69 TSHR (0.54)

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-2022148843-A1 COMPOUNDS COMPRISING A FIBROBLAST ACTIVATION PROTEIN LIGAND AND USE THEREOF 3B PHARMACEUTICALS GMBH (DE) 2022-07-14 WO disclosed