SCHEMBL4335552

SCHEMBL4335552

O=C(O)C1CC(C(=O)O)(C(=O)O)C1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 6/20 0.44
CYP2C19 P33261 4/20 0.44
CYP1A2 P05177 3/20 0.44
ALDH1A1 P00352 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
GRM8 O00222 2/20 0.44
GRM6 O15303 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
GABRR1 P24046 5/20 0.35
ALOX15 P16050 2/20 0.34
KDM4E B2RXH2 1/20 0.34
SLC6A12 P48065 1/20 0.34
SLC6A11 P48066 1/20 0.34
APLNR P35414 1/20 0.32
GRM2 Q14416 2/20 0.30
GRM3 Q14832 2/20 0.30
LMNA P02545 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
SCHEMBL2680965 0.82 GRM4 (0.39) GRM4CYP2C19CYP1A2ALDH1A1TDP1
SCHEMBL11642568 0.78 SLC6A12 (0.42) GRM4CYP2C19CYP1A2ALDH1A1TDP1
SCHEMBL9096914 0.76 MAPT (0.35) GRM4CYP2C19CYP1A2ALDH1A1TDP1
SCHEMBL28301143 0.71 GRM4 (0.33) GRM4CYP2C19CYP1A2ALDH1A1TDP1
SCHEMBL9094264 0.70 GRM4 (0.50) GRM4CYP2C19CYP1A2ALDH1A1TDP1
SCHEMBL27849837 0.70 GRM4 (0.50) GRM4CYP2C19CYP1A2ALDH1A1TDP1
SCHEMBL28871398 0.69 GRM4 (0.30) GRM4CYP2C19CYP1A2ALDH1A1TDP1
SCHEMBL9025433 0.65 GRM4 (0.35) GRM4CYP2C19CYP1A2ALDH1A1TDP1
SCHEMBL9130980 0.65 GRM4 (0.35) GRM4CYP2C19CYP1A2ALDH1A1TDP1
SCHEMBL9129838 0.65 GRM4 (0.35) GRM4CYP2C19CYP1A2ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021117692-A1 COMPOSITION FOR PATTERN FORMATION 日産化学株式会社 2021-06-17 WO disclosed
WO-2021079977-A1 TRIAZINE RING-CONTAINING POLYMER AND FILM-FORMING COMPOSITION CONTAINING SAME 日産化学株式会社 2021-04-29 WO disclosed
WO-2021079991-A1 TRIAZINE RING-CONTAINING POLYMER AND FILM-FORMING COMPOSITION CONTAINING SAME 日産化学株式会社 2021-04-29 WO disclosed
WO-2020235601-A1 POLYAMIC ACID SOLUTION, METHOD FOR PREPARING SAME, POLYAMIDE FILM, LAMINATE, METHOD FOR PRODUCING SAID LAMINATE, AND FLEXIBLE DEVICE 株式会社カネカ (JP) 2020-11-26 WO disclosed
CN-106398722-B Liquid crystal alignment agent, liquid crystal alignment film and liquid crystal display element 奇美实业股份有限公司 2018-11-02 CN disclosed
CN-108165280-A Liquid crystal alignment agent, liquid crystal alignment film and liquid crystal display element 奇美实业股份有限公司 2018-06-15 CN disclosed
CN-106398722-A Liquid crystal alignment agent, liquid crystal alignment film and liquid crystal display element 奇美实业股份有限公司 2017-02-15 CN disclosed
CN-102653157-A Lithographic printing plate precursor and plate making method thereof FUJIFILM CORP 2012-09-05 CN disclosed
CN-102649343-A Lithographic printing plate precursor and plate making method thereof FUJIFILM CORP 2012-08-29 CN disclosed
CN-102627018-A Lithographic printing plate precursor and plate making method thereof FUJIFILM CORP 2012-08-08 CN disclosed
WO-2004050981-A1 FABRIC TREATMENT UNILEVER PLC (GB) 2004-06-17 WO disclosed
EP-1368411-A1 PHOTOACTIVE POLYMER Rolic AG (CH) 2003-12-10 EP disclosed
EP-1024169-B1 Transparent articles of polyester resin COBARR SPA (IT) 2003-11-26 EP disclosed
WO-2002062873-A9 PHOTOACTIVE POLYMER ROLIC AG (CH) 2002-10-03 WO disclosed
WO-2002062873-A1 PHOTOACTIVE POLYMER ROLIC AG (CH) 2002-08-15 WO disclosed
US-20010046569-A1 Active-matrix liquid crystal display IPS ALPHA SUPPORT CO., LTD. (JP) 2001-11-29 US disclosed
US-6242060-B1 MULTILAYER HITACHI, LTD. (JP) 2001-06-05 US disclosed
EP-1024169-A1 Transparent articles of polyester resin SINCO RICERCHE S.p.A. (IT) 2000-08-02 EP disclosed
US-5928733-A Active-matrix liquid crystal display HITACHI, LTD. (JP) 1999-07-27 US disclosed
EP-0806698-A1 Active-matrix liquid crystal display HITACHI, LTD. (JP) 1997-11-12 EP disclosed