SCHEMBL1272995

SCHEMBL1272995

C=CCN[C@@H](CC(=O)NCC(=O)O)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
FAAH O00519 3/20 0.31
LMNA P02545 1/20 0.31
PTGS2 P35354 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PTPN1 P18031 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30
PTGS1 P23219 1/20 0.30
GSTK1 Q9Y2Q3 1/20 0.30
KMT2A Q03164 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
SCHEMBL176161 0.82 CA2 (0.39) ALDH1A1MAPTTSHRSMN1; SMN2TDP1
SCHEMBL176159 0.82 CA2 (0.39) ALDH1A1MAPTTSHRSMN1; SMN2TDP1
SCHEMBL8994505 0.80 CA2 (0.38) ALDH1A1SMN1; SMN2TDP1CA2CA4
SCHEMBL7482390 0.75 ECE1 (0.39) ALDH1A1MAPTTSHRCA2KMT2A
SCHEMBL10972602 0.75 ECE1 (0.39) ALDH1A1MAPTTSHRCA2KMT2A
SCHEMBL2286678 0.72 TGFBR1 (0.42) ALDH1A1MAPTTSHRSMN1; SMN2CA2
SCHEMBL2286681 0.72 TGFBR1 (0.42) ALDH1A1MAPTTSHRSMN1; SMN2CA2
SCHEMBL910825 0.72 FOLH1 (0.52) TSHRKMT2A
SCHEMBL910826 0.72 FOLH1 (0.52) TSHRKMT2A
SCHEMBL910807 0.72 FOLH1 (0.52) TSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0781146-B1 SUPER ABSORBENT POLYMER COMPOSITION KAO CORP (JP) 2001-04-18 EP claimed
EP-1791894-B1 PARTICULATE WATER-ABSORBING AGENT CONTAINING WATER-ABSORBENT RESIN AS A MAIN COMPONENT NIPPON CATALYTIC CHEM IND (JP) 2020-10-21 EP disclosed
EP-2287215-A2 Production method of water-absorbent resin, water-absorbent resin and usage of water-absorbent resin Nippon Shokubai Co., Ltd. (JP) 2011-02-23 EP disclosed
US-7510988-B2 Particulate water-absorbing agent containing water-absorbent resin as a main component NIPPON SHOKUBAI CO., LTD. (JP) 2009-03-31 US disclosed
US-20080075937-A1 Particulate Water-Absorbing Agent Containing Water-Absorbent Resin as a Main Component NIPPON SHOKUBAI CO., LTD. (JP) 2008-03-27 US disclosed
EP-1791894-A1 PARTICULATE WATER-ABSORBING AGENT CONTAINING WATER-ABSORBENT RESIN AS A MAIN COMPONENT Nippon Shokubai Co., Ltd. (JP) 2007-06-06 EP disclosed
US-20070041796-A1 Production method of water-absorbent resin, water-absorbent resin, and usage of water-absorbent resin NIPPON SHOKUBAI CO., LTD. (JP) 2007-02-22 US disclosed
EP-1754725-A2 Production method of water-absorbent resin, water-absorbent resin, and usage of water-absorbent resin Nippon Shokubai Co.,Ltd. (JP) 2007-02-21 EP disclosed
WO-2006033477-A1 PARTICULATE WATER-ABSORBING AGENT CONTAINING WATER-ABSORBENT RESIN AS A MAIN COMPONENT NIPPON SHOKUBAI CO., LTD. (JP) 2006-03-30 WO disclosed