SCHEMBL4760790

SCHEMBL4760790

CC(=O)NCC(C)(C)CS(=O)(=O)O.[CaH2]

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
MAPK1 P28482 1/20 0.37
HIF1A Q16665 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PAOX Q6QHF9 3/20 0.31
ADRA1A P35348 1/20 0.31
TSHR P16473 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
SCHEMBL7026914 0.98 KDM4E (0.38) KDM4EMAPK1HIF1ASMN1; SMN2HSD17B10
SCHEMBL11693982 0.79 TGFBR1 (0.33) SMN1; SMN2HSD17B10
SCHEMBL4760788 0.78 POLB (0.33) KDM4EMAPK1HIF1ASMN1; SMN2HSD17B10
SCHEMBL27967318 0.78 TSHR (0.41) MAPK1TSHR
SCHEMBL6770533 0.76 TSHR (0.42) MAPK1SMN1; SMN2HSD17B10TSHR
SCHEMBL27967486 0.74 TSHR (0.41) MAPK1TSHR
SCHEMBL27967487 0.74 TSHR (0.41) MAPK1TSHR
SCHEMBL28035014 0.74 TSHR (0.41) MAPK1TSHR
Ammonia Solution, Strong SCHEMBL27967314 0.74 TSHR (0.41) MAPK1TSHR
SCHEMBL27998594 0.74 TSHR (0.41) MAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4156795-B2 2008-09-24 JP claimed
JP-2002501040-A 2002-01-15 JP claimed
US-6265437-B1 ALCOHOLISM LIPHA (FR) 2001-07-24 US claimed
EP-1051393-A1 NEW DERIVATIVES OF SULFONIC, PHOSPHONIC AND PHOSPHINIC AMINOALKANE ACIDS, THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS LIPHA (FR) 2000-11-15 EP claimed
WO-1999037606-A1 NEW DERIVATIVES OF SULFONIC, PHOSPHONIC AND PHOSPHINIC AMINOALKANE ACIDS, THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS LIPHA (FR) 1999-07-29 WO claimed
EP-1056445-B1 ORALLY ADMINISTRABLE IMMEDIATE-RELEASE AND PROLONGED-RELEASE GALENIC FORM COMPRISING AN ABSORPTION-PROMOTING AGENT AND USE OF THIS ABSORPTION-PROMOTING AGENT MERCK PATENT GMBH (DE) 2004-06-02 EP disclosed
EP-1410791-A1 Orally administrable galenic form comprising metformine and an absorption-promoting agent MERCK PATENT GmbH (DE) 2004-04-21 EP disclosed
US-6514524-B1 Improved absorption of hydrophilic ingredients because of particular excipients; calcium 3-acetylamino-1-propane sulfonate (calcium acamprosate); polysorbates, fatty ethers or esters of PEG, polyglycolysed glycerides MERCK PATENTGESELLSCHAFT MIT (DE) 2003-02-04 US disclosed
US-6426087-B1 GALENIC FORMS; SUSTAINED RELEASE MERCK PATENT GESELLSCHAFT MIT (DE) 2002-07-30 US disclosed
US-6265437-B1 ALCOHOLISM LIPHA (FR) 2001-07-24 US disclosed