SCHEMBL7489357

SCHEMBL7489357

Cc1c(C)c2c(c(C)c1O)CCC(C)(C[O])O2

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.60
TSHR P16473 2/20 0.60
PTGS1 P23219 1/20 0.60
PTGS2 P35354 1/20 0.60
CYP1A2 P05177 1/20 0.60
MAPT P10636 4/20 0.57
LMNA P02545 3/20 0.57
KMT2A Q03164 3/20 0.57
USP2 O75604 2/20 0.57
CYP2C9 P11712 2/20 0.57
MEN1 O00255 2/20 0.57
GSTP1 P09211 1/20 0.57
TTPA P49638 1/20 0.57
THRB P10828 1/20 0.57
CYP2C19 P33261 1/20 0.57
NR1I2 O75469 2/20 0.56
ALOX5 P09917 5/20 0.55
CYP4F2 P78329 1/20 0.50
TP53 P04637 1/20 0.47
ALOX15 P16050 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
SCHEMBL8843112 0.88 MAPT (0.57) CYP3A4TSHRPTGS1PTGS2CYP1A2
SCHEMBL10415582 0.86 MAPT (0.59) CYP3A4TSHRPTGS1PTGS2CYP1A2
SCHEMBL7057443 0.86 MAPT (0.59) CYP3A4TSHRPTGS1PTGS2CYP1A2
SCHEMBL5672019 0.86 NR1I2 (0.61) CYP3A4TSHRPTGS1PTGS2CYP1A2
SCHEMBL5672022 0.86 NR1I2 (0.61) CYP3A4TSHRPTGS1PTGS2CYP1A2
SCHEMBL23692465 0.86 MAPT (0.59) CYP3A4TSHRPTGS1PTGS2CYP1A2
SCHEMBL2176872 0.86 NR1I2 (0.61) CYP3A4TSHRPTGS1PTGS2CYP1A2
SCHEMBL5003678 0.85 MAPT (0.62) CYP3A4TSHRPTGS1PTGS2CYP1A2
SCHEMBL10641909 0.85 MAPT (0.62) CYP3A4TSHRPTGS1PTGS2CYP1A2
SCHEMBL10642021 0.85 MAPT (0.62) CYP3A4TSHRPTGS1PTGS2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0638075-B1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMA CO LTD (JP) 2002-01-16 EP claimed
WO-1998043649-A2 AGE PRODUCTION INHIBITORY COMPOSITION COMPRISING A MAILLARD REACTION INHIBITOR AND VITAMIN B¿6? OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-10-08 WO claimed
US-5677322-A THERAPY FOR AGING, DIABETES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-10-14 US claimed
EP-0638075-A1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-02-15 EP claimed
WO-1994019335-A1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-01 WO claimed
EP-0638075-B1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMA CO LTD (JP) 2002-01-16 EP disclosed
WO-1998043649-A2 AGE PRODUCTION INHIBITORY COMPOSITION COMPRISING A MAILLARD REACTION INHIBITOR AND VITAMIN B¿6? OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-10-08 WO disclosed
US-5677322-A THERAPY FOR AGING, DIABETES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-10-14 US disclosed
EP-0638075-A1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-02-15 EP disclosed
WO-1994019335-A1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-01 WO disclosed