SCHEMBL8024758

SCHEMBL8024758

CCSCCC(N)C([NH])=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BHMT Q93088 10/20 0.43
▸ BHMT2 Q9H2M3 1/20 0.43
▸ NOS2 P35228 2/20 0.40
▸ NOS3 P29474 1/20 0.40
▸ NOS1 P29475 1/20 0.40
▸ METAP2 P50579 5/20 0.39
▸ METAP1 P53582 3/20 0.39
▸ TSHR P16473 1/20 0.38

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
SCHEMBL8021737 0.86 BHMT (0.46) BHMTBHMT2NOS2NOS3NOS1
Ethionine SCHEMBL8967 0.81 BHMT (0.63) BHMTBHMT2NOS2NOS3NOS1
Ethionine SCHEMBL8966 0.81 BHMT (0.63) BHMTBHMT2NOS2NOS3NOS1
Ethionine SCHEMBL7073863 0.81 BHMT (0.63) BHMTBHMT2NOS2NOS3NOS1
SCHEMBL29741850 0.79 BHMT (0.43) BHMTBHMT2NOS2NOS3NOS1
Ethionine SCHEMBL11572299 0.79 BHMT (0.61) BHMTBHMT2NOS2NOS3NOS1
Ethionine SCHEMBL28999714 0.79 BHMT (0.61) BHMTBHMT2NOS2NOS3NOS1
Ethionine SCHEMBL28989455 0.79 BHMT (0.61) BHMTBHMT2NOS2NOS3NOS1
SCHEMBL29359945 0.79 BHMT (0.43) BHMTBHMT2NOS2NOS3NOS1
Ethionine SCHEMBL31567824 0.79 BHMT (0.61) BHMTBHMT2NOS2NOS3NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0675133-B1 13-Substituted milbemycin derivatives, their preparation and use SANKYO CO (JP) 2000-01-12 — — EP disclosed
US-5614470-A AGRICULTURAL ANTHELMINTIC, ACARICIDE, INSECTICIDE SANKYO COMPANY, LIMITED (JP) 1997-03-25 — — US disclosed
EP-0675133-A1 13-Substituted milbemycin derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1995-10-04 — — EP disclosed
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