SCHEMBL7959970

SCHEMBL7959970

CC(C)OC(=O)C(CCCCOS(=O)(=O)c1ccccc1)OS(=O)(=O)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.36
TSHR P16473 1/20 0.35
ALDH1A1 P00352 4/20 0.33
KMT2A Q03164 4/20 0.33
GAA P10253 2/20 0.33
MMP1 P03956 3/20 0.33
MMP7 P09237 3/20 0.33
MMP12 P39900 3/20 0.33
MMP13 P45452 3/20 0.33
MEN1 O00255 3/20 0.33
ACE P12821 2/20 0.33
HPGD P15428 1/20 0.32
FABP4 P15090 1/20 0.32
CYP2C19 P33261 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
SCHEMBL7971396 0.96 RAB9A (0.37) RAB9ATSHRALDH1A1KMT2AGAA
SCHEMBL7066495 0.91 RAB9A (0.39) RAB9ATSHRALDH1A1KMT2AGAA
SCHEMBL7973483 0.89 PSMD10 (0.37) RAB9AALDH1A1KMT2AHPGD
SCHEMBL7972944 0.88 KMT2A (0.39) RAB9AKMT2AMMP1MMP7MMP12
SCHEMBL7969622 0.86 TDP1 (0.42) RAB9ATSHRALDH1A1KMT2AMEN1
SCHEMBL7973217 0.85 PSMD10 (0.38) RAB9AALDH1A1KMT2AMEN1HPGD
SCHEMBL7971318 0.84 CTRC (0.40) RAB9ATSHRALDH1A1MMP1MMP7
SCHEMBL7959874 0.84 MAPT (0.39)
SCHEMBL7972978 0.84 KMT2A (0.40) RAB9AKMT2AMMP1MMP7MMP12
SCHEMBL7969965 0.83 TSHR (0.43) RAB9ATSHRALDH1A1

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-6172234-B1 Optically active cyclic amino acid ester derivatives and processes for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-01-09 US disclosed
EP-0976729-A1 Optically active cyclic amino acid ester derivatives and processes for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-02 EP disclosed