SCHEMBL5134495

SCHEMBL5134495

CCc1c(C(=O)O)ccc(C(=O)O)c1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 3/20 0.43
GABRD O14764 3/20 0.43
GABRA1 P14867 3/20 0.43
GABRB1 P18505 3/20 0.43
GABRG2 P18507 3/20 0.43
GABRB3 P28472 3/20 0.43
GABRA5 P31644 3/20 0.43
GABRA3 P34903 3/20 0.43
GABRA2 P47869 3/20 0.43
GABRB2 P47870 3/20 0.43
GABRA4 P48169 3/20 0.43
GABRE P78334 3/20 0.43
GABRA6 Q16445 3/20 0.43
GABRG1 Q8N1C3 3/20 0.43
GABRG3 Q99928 3/20 0.43
GABRQ Q9UN88 3/20 0.43
CYP1A2 P05177 1/20 0.42
POLB P06746 1/20 0.40
ALDH1A1 P00352 5/20 0.39
SMN1; SMN2 Q16637 3/20 0.38

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
SCHEMBL75798 0.88 ALDH1A1 (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL207494 0.88 GABRP (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL294836 0.86 CYP1A2 (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL3000590 0.86 GABRP (0.40) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL18419577 0.86 SELL (0.45) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL17911667 0.86 GABRP (0.40) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28943131 0.86 GABRP (0.40) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL27317405 0.86 GABRP (0.40) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL27586519 0.84 DPP4 (0.47) GABRPGABRDGABRA1GABRB1GABRG2
Acetic Acid SCHEMBL10946506 0.84 GABRP (0.39) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022196757-A1 POLYMERIZATION INITIATOR-CONTAINING COMPOSITION AND DENTAL POLYMERIZABLE COMPOSITION サンメディカル株式会社 2022-09-22 WO disclosed
CN-106132381-B It is used to prepare the monomer mixture of dental material 义获嘉伟瓦登特公司 2019-11-19 CN disclosed
CN-106999868-B Semi-permeable membrane is laminated 东丽株式会社 2019-11-08 CN disclosed
CN-109153850-A Resin combination 株式会社艾迪科 2019-01-04 CN disclosed
CN-108697996-A Semi-permeable membrane is laminated 东丽株式会社 2018-10-23 CN disclosed
CN-108348869-A Composite semipermeable membrane and its manufacturing method 东丽株式会社 2018-07-31 CN disclosed
CN-106456452-A Self-adhesive dental composite resin 可乐丽则武齿科株式会社 2017-02-22 CN disclosed
CN-105892136-A POLARIZING PLATE AND OPTICAL DISPLAY INCLUDING THE SAME 三星SDI株式会社 2016-08-24 CN disclosed
CN-103249473-B Composite semipermeable membrane and manufacture method thereof TORAY INDUSTRIES, INC. (JP) 2016-01-13 CN disclosed
CN-103282105-A Separation membrane element TORAY INDUSTRIES 2013-09-04 CN disclosed
CN-103249473-A Composite semipermeable membrane and method for producing same TORAY INDUSTRIES 2013-08-14 CN disclosed
EP-1888817-A2 METHOD FOR PRODUCING POROUS METAL-ORGANIC FRAMEWORK MATERIALS BASF AKTIENGESELLSCHAFT (DE) 2008-02-20 EP disclosed
CN-100350892-C Primer for dental materials and pulp capping agent for dentin regeneration NIPPON SYNTHETIC CHEM IND (JP) 2007-11-28 CN disclosed
WO-2006125761-A2 METHOD FOR PRODUCING POROUS METAL-ORGANIC FRAMEWORK MATERIALS BASF AKTIENGESELLSCHAFT (DE) 2006-11-30 WO disclosed
CN-1272642-C Antireflection film laminate and method for producing same JSR CORP (JP) 2006-08-30 CN disclosed
CN-1758892-A Primer for dental materials and pulp capping agent for dentin regeneration NIPPON SYNTHETIC CHEM IND (JP) 2006-04-12 CN disclosed
CN-1520523-A Antireflection film laminate and method for producing same ������ʱ����ʽ���� 2004-08-11 CN disclosed