SCHEMBL7172499

SCHEMBL7172499

C=CCSC[C@H](N)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ARG1 P05089 1/20 0.36
▸ ARG2 P78540 1/20 0.36
▸ GRIK1 P39086 2/20 0.33
▸ GRIK2 Q13002 2/20 0.33
▸ NOS2 P35228 3/20 0.33
▸ NOS1 P29475 2/20 0.33
▸ NOS3 P29474 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
SCHEMBL11131002 1.00 ALOX5 (0.40) ALOX5SMN1; SMN2ARG1ARG2GRIK1
Hydrochloric Acid SCHEMBL9808974 0.98 ALOX5 (0.39) ALOX5SMN1; SMN2ARG1ARG2GRIK1
SCHEMBL2360318 0.83 TRPA1 (0.46) GRIK1GRIK2
SCHEMBL119988 0.83 ARG1 (0.53) ALOX5SMN1; SMN2ARG1ARG2GRIK1
SCHEMBL119989 0.83 ARG1 (0.53) ALOX5SMN1; SMN2ARG1ARG2GRIK1
SCHEMBL27630394 0.83 ARG1 (0.53) ALOX5SMN1; SMN2ARG1ARG2GRIK1
SCHEMBL16230008 0.83 ARG1 (0.53) ALOX5SMN1; SMN2ARG1ARG2GRIK1
Hydrochloric Acid SCHEMBL11572696 0.82 ARG2 (0.52) ALOX5SMN1; SMN2ARG1ARG2GRIK1
SCHEMBL13659829 0.82 ALOX5 (0.39) ALOX5SMN1; SMN2ARG1ARG2GRIK1
SCHEMBL31482265 0.82 ARG1 (0.52) ALOX5SMN1; SMN2ARG1ARG2GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003075901-A2 USE OF S-SUBSTITUTED L-CRYSTEINE FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF DERMATOLOGICAL DISORDERS GHISALBERTI CARLO (BR) 2003-09-18 — — WO disclosed
EP-0051682-B1 CYSTEINE DERIVATIVES AND PROCESS FOR THEIR PREPARATION MITSUBISHI KASEI CORPORATION (JP) 1984-09-05 — — EP disclosed
US-4440788-A REGENERATION OF LIVER CELLS MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) 1984-04-03 — — US disclosed
EP-0051682-A1 CYSTEINE DERIVATIVES AND PROCESS FOR THEIR PREPARATION MITSUBISHI KASEI CORPORATION (JP) 1982-05-19 — — EP disclosed
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