SCHEMBL28199528

SCHEMBL28199528

CCC(c1cnc(C)n1C)S(=O)(=O)O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
RORC P51449 2/20 0.32
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL28371340 0.77 ALDH1A1 (0.32) SMN1; SMN2
Sulfuric Acid SCHEMBL31265764 0.75 RORC (0.36) LMNASMN1; SMN2RORC
SCHEMBL28313922 0.67 MAOB (0.40) SMN1; SMN2
SCHEMBL2908944 0.66 CHRM5 (0.36) LMNASMN1; SMN2CA1CA2CA9
SCHEMBL27998888 0.66 L3MBTL1 (0.42) LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL27709943 0.65 CHRM5 (0.35) LMNASMN1; SMN2CA1CA2CA9
Hydrochloric Acid SCHEMBL29043668 0.65 L3MBTL1 (0.41) LMNASMN1; SMN2
Sulfuric Acid SCHEMBL28423116 0.65 L3MBTL1 (0.41) LMNASMN1; SMN2
Bromide SCHEMBL28320357 0.65 L3MBTL1 (0.41) LMNASMN1; SMN2
SCHEMBL31265747 0.63 S1PR1 (0.32) SMN1; SMN2RORC

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107721932-A The method of purifying ampholytic ionic liquid presoma 上海纳米技术及应用国家工程研究中心有限公司 2018-02-23 CN disclosed