SCHEMBL29016153

SCHEMBL29016153

O=S(Oc1ncccc1O)Oc1ncccc1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MMP2 P08253 1/20 0.39
CHRM1 P11229 1/20 0.39
TSHR P16473 1/20 0.39
COMT P21964 1/20 0.39
ADRA1A P35348 1/20 0.39
METAP2 P50579 1/20 0.39
METAP1 P53582 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
KDM4E B2RXH2 5/20 0.38
ALOX12 P18054 2/20 0.38
HPGD P15428 1/20 0.36
ERN1 O75460 1/20 0.36
G6PD P11413 1/20 0.34
EGLN2 Q96KS0 1/20 0.34
FTO Q9C0B1 1/20 0.34
TLR7 Q9NYK1 2/20 0.33
LMNA P02545 1/20 0.33
NPC1 O15118 2/20 0.33

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
SCHEMBL10514419 0.76 ALDH1A1 (0.46) ALDH1A1L3MBTL1MMP2CHRM1TSHR
SCHEMBL1685043 0.72
SCHEMBL28020728 0.72 ERN1 (0.43) ALDH1A1L3MBTL1MMP2CHRM1TSHR
SCHEMBL2304200 0.72 FTO (0.41) ALDH1A1L3MBTL1MMP2CHRM1TSHR
SCHEMBL7605126 0.71 KDM4E (0.41) ALDH1A1L3MBTL1MMP2CHRM1TSHR
SCHEMBL28806916 0.71 KDM4E (0.44) ALDH1A1L3MBTL1MMP2CHRM1TSHR
SCHEMBL238514 0.69 ALDH1A1 (0.49) ALDH1A1L3MBTL1TSHRKDM4EHPGD
SCHEMBL18320509 0.69 TLR7 (0.47) ALDH1A1L3MBTL1MMP2CHRM1TSHR
SCHEMBL30785493 0.69 TLR7 (0.47) ALDH1A1L3MBTL1MMP2CHRM1TSHR
Sulfurous Acid SCHEMBL29016156 0.68 ALDH1A1 (0.43) ALDH1A1L3MBTL1MMP2CHRM1TSHR

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
CN-115873017-A Cyclic sulfite compound, electrolyte and lithium ion battery 比亚迪股份有限公司 2023-03-31 CN claimed
CN-115873017-A Cyclic sulfite compound, electrolyte and lithium ion battery 比亚迪股份有限公司 2023-03-31 CN disclosed