SCHEMBL31435683

SCHEMBL31435683

O=S(=O)(Cc1ccccc1)C1CCC(O)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
MMP8 P22894 1/20 0.47
MMP13 P45452 1/20 0.47
PRSS1 P07477 2/20 0.42
PRSS2 P07478 2/20 0.42
PRSS3 P35030 2/20 0.42
FAAH O00519 1/20 0.42
ELANE P08246 1/20 0.42
PRTN3 P24158 1/20 0.42
CA5A P35218 1/20 0.42
CA9 Q16790 1/20 0.42
RORC P51449 4/20 0.41
TSHR P16473 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HPGD P15428 3/20 0.41
HSD17B10 Q99714 2/20 0.41

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
SCHEMBL21234184 0.83 HPGD (0.51) CA1CA2MMP1MMP2MMP9
SCHEMBL3244251 0.81 HPGD (0.54) CA1CA2MMP1MMP2MMP9
SCHEMBL24969444 0.79 CRBN (0.43) CA1CA2MMP1MMP2MMP9
SCHEMBL3124142 0.79 CA1 (0.43) CA1CA2MMP1MMP2MMP9
SCHEMBL10800380 0.79 GBA1 (0.50) CA1CA2MMP1MMP2MMP9
SCHEMBL18460809 0.76 HTR2A (0.47) TSHRHPGDHSD17B10USP2NPC1
SCHEMBL20206024 0.76 HTR2A (0.45) CA1CA2MMP1MMP2MMP9
SCHEMBL8551473 0.75 HTR2A (0.68) TSHRSMN1; SMN2NPC1
Hydrochloric Acid SCHEMBL8552504 0.73 HTR2A (0.66) SMN1; SMN2NPC1ALDH1A1
SCHEMBL20069159 0.73 HTR2A (0.50) RORCSMN1; SMN2HPGDNPC1RAB9A

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-119569729-A DSC-BTrzPhen ligand, preparation method and application thereof, and method for separating lanthanoid element and actinoid element from waste liquid 兰州大学 2025-03-07 CN claimed
CN-119569729-A DSC-BTrzPhen ligand, preparation method and application thereof, and method for separating lanthanoid element and actinoid element from waste liquid 兰州大学 2025-03-07 CN disclosed