SCHEMBL8060845

SCHEMBL8060845

CCC(CO)NCc1ccc(C)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
ALOX12 P18054 1/20 0.55
LMNA P02545 2/20 0.47
KDM4E B2RXH2 2/20 0.47
CNR1 P21554 1/20 0.47
ADRA1A P35348 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.45
ABCC3 O15438 1/20 0.45
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
POLB P06746 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41

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
Hydrochloric Acid SCHEMBL3673299 0.90 ALDH1A1 (0.63) ALDH1A1ALOX12LMNAKDM4ECNR1
SCHEMBL10706332 0.84 ALDH1A1 (0.54) ALDH1A1ALOX12LMNAKDM4ECNR1
SCHEMBL10706925 0.84 ALDH1A1 (0.54) ALDH1A1ALOX12LMNAKDM4ECNR1
SCHEMBL11410649 0.84 ALDH1A1 (0.54) ALDH1A1ALOX12LMNAKDM4ECNR1
SCHEMBL11418172 0.84 ALDH1A1 (0.54) ALDH1A1ALOX12LMNAKDM4ECNR1
SCHEMBL4171219 0.83 ALDH1A1 (0.52) ALDH1A1ALOX12LMNAKDM4ECNR1
SCHEMBL1318063 0.83 ALDH1A1 (0.52) ALDH1A1ALOX12LMNAKDM4ECNR1
SCHEMBL1848291 0.83 ALDH1A1 (0.52) ALDH1A1ALOX12LMNAKDM4ECNR1
Hydrochloric Acid SCHEMBL10836397 0.81 ALDH1A1 (0.55) ALDH1A1ALOX12LMNAKDM4ECNR1
SCHEMBL8069918 0.81 ALDH1A1 (0.62) ALDH1A1ALOX12LMNATDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0780358-A1 A process for the resolution of 6-methoxy-alpha-methyl-2-naphthaleneacetic racemic acid into its enantiomers FARCHEMIA S.r.l. (IT) 1997-06-25 EP claimed
EP-0780358-B1 A process for the resolution of 6-methoxy-alpha-methyl-2-naphthaleneacetic racemic acid into its enantiomers FARCHEMIA SRL (IT) 2000-07-19 EP disclosed
US-5760287-A Process for the resolution of 6-methoxy-alpha-methyl-2-naphthaleneacetic racemic acid into its enantiomers FARCHEMIA S.R.L. (IT) 1998-06-02 US disclosed
EP-0780358-A1 A process for the resolution of 6-methoxy-alpha-methyl-2-naphthaleneacetic racemic acid into its enantiomers FARCHEMIA S.r.l. (IT) 1997-06-25 EP disclosed