SCHEMBL11074362

SCHEMBL11074362

C/C=C/CNC(=O)OCC1(C(C)=O)CC2C=CC1C2

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL11074365 1.00 ALDH1A1 (0.33) ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL11260303 0.87 ALDH1A1 (0.34) ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL11077973 0.87 ALDH1A1 (0.34) ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL11102700 0.84 ALDH1A1 (0.49) ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL11255313 0.83
SCHEMBL11078286 0.83
SCHEMBL11255680 0.82 ALDH1A1 (0.35) ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL11252003 0.82 MEN1 (0.39) ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL11256657 0.82 MEN1 (0.51) ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL11072312 0.82 MEN1 (0.51) ALDH1A1MEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0026369-B1 CARBAMATES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BASF Aktiengesellschaft (DE) 1984-08-08 EP disclosed
US-4335138-A HYPNOTIC, SEDATIVE BASF AKTIENGESELLSCHAFT (DE) 1982-06-15 US disclosed
EP-0026369-A2 Carbamates, their preparation and pharmaceutical compositions containing them BASF Aktiengesellschaft (DE) 1981-04-08 EP disclosed