SCHEMBL6851820

SCHEMBL6851820

[O]S(=O)(=O)c1c(O)cc(O)cc1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
HPGD P15428 2/20 0.39
TDP1 Q9NUW8 3/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 2/20 0.38
MAPT P10636 2/20 0.38
APEX1 P27695 2/20 0.38
MAPK1 P28482 2/20 0.38
ELANE P08246 2/20 0.38
NPC1 O15118 1/20 0.38
PTP4A3 O75365 1/20 0.38
GMNN O75496 1/20 0.38
LMNA P02545 1/20 0.38
ESR1 P03372 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A1 P04798 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38

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
SCHEMBL2114012 0.80 CYP3A4 (0.40) CYP3A4MEN1KMT2AHPGDTDP1
SCHEMBL23484448 0.78 CA2 (0.44) CYP3A4MEN1KMT2AHPGDTDP1
SCHEMBL668197 0.78 NQO1 (0.42) CYP3A4MEN1KMT2AHPGDTDP1
SCHEMBL34468636 0.76 CYP3A4 (0.42) CYP3A4MEN1KMT2AHPGDTDP1
SCHEMBL28921036 0.74 PTPN1 (0.43) CYP3A4MEN1KMT2AHPGDPOLB
Potassium Ion SCHEMBL28961632 0.74 PTGS1 (0.43) CYP3A4MEN1KMT2AHPGDTDP1
SCHEMBL34468664 0.70 L3MBTL1 (0.40) CYP3A4MEN1KMT2AHPGDTDP1
SCHEMBL2114380 0.70 CYP3A4 (0.47) CYP3A4MEN1KMT2AHPGDTDP1
SCHEMBL28233042 0.70 HSD17B10 (0.42) CYP3A4MEN1KMT2AHPGDTDP1
SCHEMBL34468655 0.67 KMT2A (0.41) CYP3A4MEN1KMT2AHPGDTDP1

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-6783913-B2 POLYMERIC ACETAL RESIN CONTAINS UNITS (A), (B), (C), (D), AND (E). UNIT (A) IS A VINYL ALCOHOL UNIT. UNIT; (B) IS A POLYVINYL ACETAL UNIT CONTAINING AN R GROUP, WHERE R IS HYDROGEN, AN ALIPHATIC GROUP, AN AROMATIC GROUP, OR AN KODAK POLYCHROME GRAPHICS LLC 2004-08-31 US claimed
US-20030198887-A1 Polymeric acetal resins containing free radical inhibitors and their use in lithographic printing EASTMAN KODAK COMPANY 2003-10-23 US claimed