SCHEMBL6557653

SCHEMBL6557653

CCOC(=O)C(Cc1ccc(Cl)cc1)(NC(C)=O)C(=O)OCC

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.74
RECQL P46063 1/20 0.74
PKM P14618 2/20 0.54
KDM4E B2RXH2 1/20 0.54
THRB P10828 1/20 0.53
HTT P42858 1/20 0.51
MAPK1 P28482 1/20 0.48
CYP3A4 P08684 3/20 0.48
ATM Q13315 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAPT P10636 2/20 0.48
CYP1A2 P05177 2/20 0.48
ABCB11 O95342 1/20 0.48
TSHR P16473 1/20 0.48
HTR2A P28223 1/20 0.48
PMP22 Q01453 1/20 0.48
PPARA Q07869 1/20 0.48
OPRK1 P41145 1/20 0.47

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
SCHEMBL9556830 0.89 ALDH1A1 (0.74) ALDH1A1RECQLPKMKDM4ETHRB
SCHEMBL11124323 0.88 ALDH1A1 (0.78) ALDH1A1RECQLPKMKDM4ETHRB
SCHEMBL9556731 0.87 ALDH1A1 (0.76) ALDH1A1RECQLPKMKDM4ETHRB
SCHEMBL6782409 0.87 ALDH1A1 (0.76) ALDH1A1RECQLPKMKDM4ETHRB
SCHEMBL25942340 0.86 ALDH1A1 (0.74) ALDH1A1RECQLPKMKDM4ETHRB
SCHEMBL27631086 0.86 ALDH1A1 (0.74) ALDH1A1RECQLPKMKDM4ETHRB
SCHEMBL8495876 0.86 ALDH1A1 (0.74) ALDH1A1RECQLPKMKDM4ETHRB
SCHEMBL589164 0.86 ALDH1A1 (0.74) ALDH1A1RECQLPKMKDM4ETHRB
SCHEMBL9849155 0.86 ALDH1A1 (0.74) ALDH1A1RECQLPKMKDM4ETHRB
SCHEMBL27395266 0.85 ALDH1A1 (1.00) ALDH1A1RECQLPKMKDM4ETHRB

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-1069109-B1 Process for production of optically active N-protected-N-methyl-phenylalanine derivative AJINOMOTO KK (JP) 2004-03-03 EP disclosed
US-6342629-B1 ENANTIOMORPHS FROM REACTION OF CYCLOHEXYLAMINE OR DICYCLOHEXYLAMINE AND ISOLATION AJINOMOTO CO., INC. (JP) 2002-01-29 US disclosed
EP-1069109-A1 Process for production of optically active N-protected-N-methyl-phenylalanine derivative Ajinomoto Co., Inc. (JP) 2001-01-17 EP disclosed