SCHEMBL5310285

SCHEMBL5310285

CON(OC)C(C)(Cc1ccc(O)c(O)c1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.57
KDM4E B2RXH2 5/20 0.57
TDP1 Q9NUW8 5/20 0.57
POLB P06746 3/20 0.57
MAPT P10636 3/20 0.57
HPGD P15428 3/20 0.57
CYP3A4 P08684 3/20 0.57
ALOX15 P16050 3/20 0.57
ALDH1A1 P00352 3/20 0.57
GAA P10253 3/20 0.57
PMP22 Q01453 3/20 0.57
CYP1A2 P05177 2/20 0.57
APEX1 P27695 2/20 0.57
BLM P54132 2/20 0.57
USP2 O75604 2/20 0.57
EGFR P00533 2/20 0.57
FYN P06241 2/20 0.57
ADRA1A P35348 2/20 0.57
PTGS2 P35354 2/20 0.57
RECQL P46063 2/20 0.57

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
SCHEMBL6720098 0.83 HSD17B10 (0.62) HSD17B10KDM4ETDP1POLBMAPT
SCHEMBL6720093 0.83 HSD17B10 (0.62) HSD17B10KDM4ETDP1POLBMAPT
SCHEMBL10108985 0.79 HSD17B10 (0.61) HSD17B10KDM4ETDP1POLBMAPT
SCHEMBL10124214 0.78 HSD17B10 (0.64) HSD17B10KDM4ETDP1POLBMAPT
SCHEMBL13644181 0.76 KDM4E (0.70) HSD17B10KDM4ETDP1POLBMAPT
SCHEMBL12608313 0.75 HSD17B10 (0.52) HSD17B10KDM4ETDP1POLBMAPT
SCHEMBL13987942 0.74 HSD17B10 (0.75) HSD17B10KDM4ETDP1POLBMAPT
SCHEMBL24666864 0.73 HSD17B10 (0.66) HSD17B10KDM4ETDP1POLBMAPT
Methyldopa SCHEMBL34003 0.73 KDM4E (1.00) HSD17B10KDM4ETDP1POLBMAPT
Methyldopa (Racemic) SCHEMBL196981 0.73 KDM4E (1.00) HSD17B10KDM4ETDP1POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007042848-A2 PROCESS FOR THE PREPARATION OF CARBIDOPA EGIS GYÓGYSZERGYÁR (HU) 2007-04-19 WO disclosed