SCHEMBL4598009

SCHEMBL4598009

CCCCCCCCCCOC(=O)CC(O)(CC(=O)O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.53
ALDH1A1 P00352 1/20 0.48
RAD52 P43351 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
FAAH O00519 1/20 0.45
DGKA P23743 1/20 0.44
HTR2C P28335 1/20 0.44
HCAR2 Q8TDS4 1/20 0.42
EPHX1 P07099 1/20 0.42
S1PR4 O95977 1/20 0.42
S1PR1 P21453 1/20 0.42
S1PR3 Q99500 1/20 0.42
S1PR5 Q9H228 1/20 0.42
HSPD1 P10809 1/20 0.42
BLM P54132 1/20 0.42
HSPE1 P61604 1/20 0.42
TSHR P16473 1/20 0.41
ACHE P22303 1/20 0.41

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
SCHEMBL320757 1.00 NAAA (0.53) NAAAALDH1A1RAD52NPSR1FAAH
SCHEMBL31397812 1.00 NAAA (0.53) NAAAALDH1A1RAD52NPSR1FAAH
SCHEMBL1400504 1.00 NAAA (0.53) NAAAALDH1A1RAD52NPSR1FAAH
SCHEMBL42510 1.00 NAAA (0.53) NAAAALDH1A1RAD52NPSR1FAAH
SCHEMBL2145409 1.00 NAAA (0.53) NAAAALDH1A1RAD52NPSR1FAAH
SCHEMBL43836 1.00 NAAA (0.53) NAAAALDH1A1RAD52NPSR1FAAH
SCHEMBL9410612 1.00 NAAA (0.53) NAAAALDH1A1RAD52NPSR1FAAH
SCHEMBL17812796 1.00 NAAA (0.53) NAAAALDH1A1RAD52NPSR1FAAH
SCHEMBL17812513 1.00 NAAA (0.53) NAAAALDH1A1RAD52NPSR1FAAH
SCHEMBL31632218 1.00 NAAA (0.53) NAAAALDH1A1RAD52NPSR1FAAH

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315576-B Preparation method of bio-based degradable plasticizer 山东万图高分子材料股份有限公司 2024-08-20 CN claimed
CN-114315576-A Preparation method of bio-based degradable plasticizer 山东万图高分子材料股份有限公司 2022-04-12 CN claimed
CN-103554107-A Azaadamantane derivatives and methods of use ABBOTT LAB 2014-02-05 CN claimed
CN-1545508-B 1,2,4-trioxolane antimalarials MEDICINES MALARIA VENTURE MMV 2012-06-06 CN claimed
CN-101541792-A Azaadamantane derivatives and methods of use ABBOTT LAB (US) 2009-09-23 CN claimed
CN-1545508-A 1,2,4-trioxolane antimalarials ű��ҩ�﹫˾ 2004-11-10 CN claimed
US-4391938-A ESTERS ROHM AND HAAS COMPANY (US) 1983-07-05 US claimed
CN-114315576-B Preparation method of bio-based degradable plasticizer 山东万图高分子材料股份有限公司 2024-08-20 CN disclosed
CN-114315576-A Preparation method of bio-based degradable plasticizer 山东万图高分子材料股份有限公司 2022-04-12 CN disclosed
CN-112574038-A Selective synthesis method of citric acid monoester 北京微量化学研究所 2021-03-30 CN disclosed
CN-106074548-A Monohydrate of azaadamantane derivative 艾伯维巴哈马有限公司 2016-11-09 CN disclosed
CN-103554107-B AZAADAMANTANE DERIVATIVES AND METHODS OF USE 艾伯维巴哈马有限公司 2016-08-17 CN disclosed
US-9365715-B2 Thermoplastic elastomer composition and method for the production thereof STYROLUTION EUROPE GMBH (DE) 2016-06-14 US disclosed
WO-2004055104-A1 ALIPHATIC POLYESTER RESIN COMPOSITION 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-07-01 WO disclosed
CN-1134418-C Substituted pyrazolyl benzenesulfonamides for treating inflammation - 2004-01-14 CN disclosed
EP-0473915-A1 Improved barrier PVC resins, compounds and articles derived therefrom THE B.F. GOODRICH COMPANY (US) 1992-03-11 EP disclosed
EP-0358181-A2 Polyvinyl chloride blends having improved physical properties The Geon Company (US) 1990-03-14 EP disclosed
EP-0138147-A2 Citrate-ester plasticized PVC blood containers Bayer Corporation (US) 1985-04-24 EP disclosed
US-4391938-A ESTERS ROHM AND HAAS COMPANY (US) 1983-07-05 US disclosed
US-4271032-A Polycarboxylic acids and esters in detergent formulations and their use TEXACO INC. (US) 1981-06-02 US disclosed