Hydrogen Sulfide

Hydrogen Sulfide

SCHEMBL28792291

ClOCl.OCCC1CCCO1.S

nearest known ligand 0.40

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Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 2/20 0.38
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HPGD P15428 3/20 0.35
TP53 P04637 1/20 0.35
ALOX12 P18054 1/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 2/20 0.33
TSHR P16473 1/20 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
SCHEMBL14251172 0.89
SCHEMBL313343 0.89
SCHEMBL15074245 0.89
Methylene Chloride SCHEMBL10495455 0.88 POLB (0.38) POLBLMNAALDH1A1USP2SMN1; SMN2
Water SCHEMBL1315360 0.87
Hydrochloric Acid SCHEMBL27837501 0.87
Ammonia Solution, Strong SCHEMBL11240480 0.87
Chloroform SCHEMBL1018463 0.86 POLB (0.37) POLBLMNAALDH1A1USP2SMN1; SMN2
Methyl Alcohol SCHEMBL2743758 0.85 KMT2A (0.40) POLBLMNAALDH1A1USP2SMN1; SMN2
Hydrogen Sulfide SCHEMBL27855404 0.83 LMNA (0.42) POLBLMNAALDH1A1USP2SMN1; SMN2

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-102344446-B Cis-nitenpyram analog containing carboxylic acid-substituted methyl ester and preparation method and application thereof UNIV SHANGHAI 2014-04-09 CN disclosed
CN-102344446-A Cis-nitenpyram analog containing carboxylic acid-substituted methyl ester and preparation method and application thereof UNIV SHANGHAI 2012-02-08 CN disclosed