SCHEMBL29587288

SCHEMBL29587288

O=S(=O)(OC(O)CO)c1ccccc1.[Na]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTR6 P50406 1/20 0.38
TDP1 Q9NUW8 3/20 0.38
PARL Q9H300 1/20 0.38
PSIP1 O75475 1/20 0.38
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
APOBEC3G Q9HC16 1/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
MMP8 P22894 1/20 0.36
MMP13 P45452 1/20 0.36
HSD11B1 P28845 1/20 0.36

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
SCHEMBL28520168 0.98 ALDH1A1 (0.40) ALDH1A1TSHRSMN1; SMN2HTR6TDP1
SCHEMBL28522691 0.98 ALDH1A1 (0.40) ALDH1A1TSHRSMN1; SMN2HTR6TDP1
Lithium SCHEMBL29588177 0.98 ALDH1A1 (0.40) ALDH1A1TSHRSMN1; SMN2HTR6TDP1
SCHEMBL8959006 0.82 SMN1; SMN2 (0.41) ALDH1A1TSHRSMN1; SMN2HTR6TDP1
SCHEMBL11305845 0.78 TDP1 (0.46) ALDH1A1TSHRSMN1; SMN2TDP1PSIP1
SCHEMBL8142044 0.76 SMN1; SMN2 (0.43) ALDH1A1TSHRSMN1; SMN2HTR6TDP1
SCHEMBL27649979 0.76 TSHR (0.43) ALDH1A1TSHRSMN1; SMN2HTR6TDP1
SCHEMBL477080 0.75 PARL (0.38) ALDH1A1TSHRSMN1; SMN2HTR6TDP1
SCHEMBL28035267 0.75 ALDH1A1 (0.36) ALDH1A1TSHRSMN1; SMN2HTR6TDP1
SCHEMBL23249535 0.74 SMN1; SMN2 (0.41) ALDH1A1TSHRSMN1; SMN2HTR6TDP1

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
CN-112382788-B Single-ion conductive polymer electrolyte and preparation method and application thereof 合肥国轩高科动力能源有限公司 2022-04-12 CN claimed
CN-112382788-B Single-ion conductive polymer electrolyte and preparation method and application thereof 合肥国轩高科动力能源有限公司 2022-04-12 CN disclosed
CN-112382788-B Single-ion conductive polymer electrolyte and preparation method and application thereof 合肥国轩高科动力能源有限公司 2022-04-12 CN disclosed