SCHEMBL28620949

SCHEMBL28620949

CCCCCCCCCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCC)S(=O)(=O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.46
CA1 P00915 4/20 0.43
CA2 P00918 3/20 0.43
PPARA Q07869 2/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
FAAH O00519 2/20 0.41
S1PR2 O95136 1/20 0.41
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41
S1PR5 Q9H228 1/20 0.41
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL5253616 1.00 DNM1 (0.46) DNM1CA1CA2PPARACA12
SCHEMBL7024697 1.00 DNM1 (0.46) DNM1CA1CA2PPARACA12
SCHEMBL7026899 1.00 DNM1 (0.46) DNM1CA1CA2PPARACA12
SCHEMBL28640485 1.00 DNM1 (0.46) DNM1CA1CA2PPARACA12
SCHEMBL28621286 1.00 DNM1 (0.46) DNM1CA1CA2PPARACA12
SCHEMBL8211598 1.00 DNM1 (0.46) DNM1CA1CA2PPARACA12
SCHEMBL28635214 1.00 DNM1 (0.46) DNM1CA1CA2PPARACA12
SCHEMBL5252089 0.97 CA1 (0.42) DNM1CA1CA2PPARACA12
SCHEMBL1035915 0.90 CA1 (0.43) CA1CA2PPARACA12CA9
SCHEMBL6310499 0.89 EPHX2 (0.39) DNM1CA1CA2PPARACA12

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-113252759-A Electrochemical gas sensor and electrolyte for electrochemical gas sensor 德尔格安全股份两合公司 2021-08-13 CN disclosed