SCHEMBL4760786

SCHEMBL4760786

CC(=O)NCC(C)CS(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.38
HIF1A Q16665 1/20 0.38
MTNR1A P48039 7/20 0.36
MTNR1B P49286 7/20 0.36
PAOX Q6QHF9 3/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
ADRA1A P35348 1/20 0.31
SLC22A6 Q4U2R8 1/20 0.31
TSHR P16473 1/20 0.31
GRIA1 P42261 3/20 0.30
ALDH1A1 P00352 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
SCHEMBL6572287 0.98 KDM4E (0.37) KDM4EMAPK1HIF1AMTNR1AMTNR1B
SCHEMBL462252 0.81 TGFBR1 (0.37)
SCHEMBL6572284 0.80 MTNR1A (0.34) KDM4EMAPK1HIF1AMTNR1AMTNR1B
SCHEMBL21081957 0.80 TGFBR1 (0.36)
SCHEMBL9419167 0.80 TGFBR1 (0.36)
SCHEMBL10062233 0.79 MTNR1A (0.44) KDM4EMAPK1HIF1AMTNR1AMTNR1B
SCHEMBL12052272 0.79 KDM4E (0.38) KDM4EMAPK1HIF1AMTNR1AMTNR1B
SCHEMBL5195022 0.79 SLC22A6 (0.32) SLC22A6
Ammonia Solution, Strong SCHEMBL27948392 0.78 KDM4E (0.37) KDM4EMAPK1HIF1AMTNR1AMTNR1B
SCHEMBL23888730 0.77 TSHR (0.42) MAPK1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4156795-B2 2008-09-24 JP claimed
EP-1051393-B1 NEW DERIVATIVES OF SULFONIC, PHOSPHONIC AND PHOSPHINIC AMINOALKANE ACIDS, THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS MERCK SANTE SAS (FR) 2003-10-01 EP claimed
JP-2002501040-A 2002-01-15 JP 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
CN-112384602-A Process for preparing stabilized polymers containing vinylimidazoles 巴斯夫欧洲公司 2021-02-19 CN disclosed
EP-3679118-A1 WASHING- AND CLEANING-ACTIVE POLYMER FILMS, PROCESS FOR THEIR PRODUCTION AND THEIR USE BASF SE (DE) 2020-07-15 EP disclosed
CN-111278960-A Washing and cleaning active polymer membranes, method for the production thereof and use thereof 巴斯夫欧洲公司 2020-06-12 CN disclosed
WO-2019048474-A1 WASHING- AND CLEANING-ACTIVE POLYMER FILMS, PROCESS FOR THEIR PRODUCTION AND THEIR USE BASF SE (DE) 2019-03-14 WO disclosed
EP-1051393-B1 NEW DERIVATIVES OF SULFONIC, PHOSPHONIC AND PHOSPHINIC AMINOALKANE ACIDS, THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS MERCK SANTE SAS (FR) 2003-10-01 EP disclosed
US-6265437-B1 ALCOHOLISM LIPHA (FR) 2001-07-24 US disclosed
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 disclosed
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 disclosed