SCHEMBL9658142

SCHEMBL9658142

CC(=O)C1CC(C)=CC(C)C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
ALOX15 P16050 1/20 0.33
CTNNB1 P35222 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL22644812 0.84 ALDH1A1 (0.47) ALDH1A1LMNAPOLBALOX15CTNNB1
SCHEMBL14017966 0.82 ALOX15 (0.38) ALDH1A1LMNAPOLBALOX15CTNNB1
SCHEMBL13556207 0.76 ALDH1A1 (0.31) ALDH1A1POLBALOX15
SCHEMBL22924482 0.70
Methyl Alcohol SCHEMBL585252 0.70 ALDH1A1 (0.35) ALDH1A1LMNAPOLB
SCHEMBL17581051 0.69
SCHEMBL2380963 0.69
SCHEMBL718948 0.69
SCHEMBL1472554 0.68 ALOX15 (0.37) ALDH1A1LMNAPOLBALOX15CTNNB1
SCHEMBL1781860 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5175143-A Perfumery materials UNILEVER PATENT HOLDINGS B.V. (NL) 1992-12-29 US disclosed
EP-0276998-A2 Perfumery materials UNILEVER PLC (GB) 1988-08-03 EP disclosed