SCHEMBL8773060

SCHEMBL8773060

O=S(=O)(O)c1c(CO)c(CO)cc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.49
ACP1 P24666 1/20 0.37
CYP1A2 P05177 3/20 0.35
CYP2C19 P33261 3/20 0.35
HSD17B10 Q99714 3/20 0.35
MPL P40238 2/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP2C9 P11712 2/20 0.35
HIF1A Q16665 2/20 0.35
ALOX15 P16050 1/20 0.35
ATIC P31939 1/20 0.35
CTRC Q99895 1/20 0.35
TSHR P16473 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HTR2A P28223 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ME2 P23368 1/20 0.35
ME1 P48163 1/20 0.35
ME3 Q16798 1/20 0.35
KDM4E B2RXH2 2/20 0.34

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
SCHEMBL2519857 0.82 CYP2D6 (0.48) CYP2D6ACP1CYP1A2CYP2C19HSD17B10
Ammonia Solution, Strong SCHEMBL23749119 0.81 CYP2D6 (0.47) CYP2D6ACP1CYP1A2CYP2C19HSD17B10
SCHEMBL8157500 0.80 CYP2D6 (0.59) CYP2D6CYP1A2CYP2C19HSD17B10MPL
Formaldehyde SCHEMBL10789305 0.80 CYP2D6 (0.46) CYP2D6ACP1CYP1A2CYP2C19HSD17B10
SCHEMBL9465234 0.79 CYP2D6 (0.51) CYP2D6ACP1CYP1A2CYP2C19HSD17B10
SCHEMBL10890143 0.79 CYP2D6 (0.43) CYP2D6ACP1CYP1A2TSHRKDM4E
SCHEMBL2526339 0.78 GPR84 (0.47) CYP2D6ACP1ALDH1A1KDM4EHPGD
SCHEMBL289480 0.78 CYP2D6 (0.42) CYP2D6HSD17B10ALDH1A1KDM4EHPGD
SCHEMBL9838417 0.78 CYP2D6 (0.50) CYP2D6ACP1CYP1A2CYP2C19HSD17B10
SCHEMBL150862 0.78 CYP2D6 (0.50) CYP2D6ACP1CYP1A2CYP2C19HSD17B10

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-0383995-B1 Aromatic thermosetting resins and preparation thereof SUMIKIN CHEMICAL (JP) 1997-10-15 EP disclosed
US-5017683-A Organic acid catalyst SUMIKIN CHEMICAL CO., LTD. (JP) 1991-05-21 US disclosed
EP-0383995-A2 Aromatic thermosetting resins and preparation thereof SUMIKIN CHEMICAL CO., LTD. (JP) 1990-08-29 EP disclosed