SCHEMBL9436291

SCHEMBL9436291

CCC(CCCCCCCC(=O)O)CCC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTK1 Q9Y2Q3 2/20 0.57
FFAR4 Q5NUL3 2/20 0.55
FFAR1 O14842 2/20 0.55
ALDH1A1 P00352 3/20 0.53
GPR84 Q9NQS5 7/20 0.52
PPARG P37231 7/20 0.52
PPARD Q03181 7/20 0.52
PPARA Q07869 7/20 0.52
HDAC11 Q96DB2 5/20 0.52
TSHR P16473 5/20 0.52
PTPN1 P18031 3/20 0.52
TLR2 O60603 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
FABP4 P15090 2/20 0.52
SLC22A6 Q4U2R8 1/20 0.52
SLC22A8 Q8TCC7 1/20 0.52
MEN1 O00255 1/20 0.52
ESR1 P03372 1/20 0.52
ALOX15 P16050 1/20 0.52
PDE4A P27815 1/20 0.52

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
SCHEMBL28662084 1.00 GSTK1 (0.57) GSTK1FFAR4FFAR1ALDH1A1GPR84
SCHEMBL14777940 1.00 GSTK1 (0.57) GSTK1FFAR4FFAR1ALDH1A1GPR84
SCHEMBL14809946 1.00 GSTK1 (0.57) GSTK1FFAR4FFAR1ALDH1A1GPR84
SCHEMBL14360772 1.00 GSTK1 (0.57) GSTK1FFAR4FFAR1ALDH1A1GPR84
Hydrochloric Acid SCHEMBL14809188 0.98 GSTK1 (0.55) GSTK1FFAR4FFAR1ALDH1A1GPR84
Hydrochloric Acid SCHEMBL14809858 0.98 GSTK1 (0.55) GSTK1FFAR4FFAR1ALDH1A1GPR84
Hydrochloric Acid SCHEMBL14809564 0.98 GSTK1 (0.55) GSTK1FFAR4FFAR1ALDH1A1GPR84
Hydrochloric Acid SCHEMBL14809039 0.98 GSTK1 (0.55) GSTK1FFAR4FFAR1ALDH1A1GPR84
Hydrochloric Acid SCHEMBL14809576 0.98 GSTK1 (0.55) GSTK1FFAR4FFAR1ALDH1A1GPR84
Hydrochloric Acid SCHEMBL14809667 0.98 GSTK1 (0.55) GSTK1FFAR4FFAR1ALDH1A1GPR84

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
CN-112969561-B Vinyl chloride resin composition, vinyl chloride resin molded article, and laminate 日本瑞翁株式会社 2023-04-14 CN disclosed
CN-112969561-A Vinyl chloride resin composition, vinyl chloride resin molded article, and laminate 日本瑞翁株式会社 2021-06-15 CN disclosed
WO-2020196396-A1 VINYL CHLORIDE RESIN COMPOSITION, VINYL CHLORIDE RESIN MOLDED ARTICLE, AND LAMINATE 日本ゼオン株式会社 2020-10-01 WO disclosed
US-5360891-A Colorless and transparent, amorphously processable polyamide molding composition having good resistance to stress cracking and good impact strength HUELS AKTIENGESELLSCHAFT (DE) 1994-11-01 US disclosed
EP-0012931-B1 COPOLYAMIDES BASED ON A MIXTURE OF CYCLOALIPHATIC AMINES AND MOULDED ARTICLES THEREOF BAYER AG (DE) 1983-09-14 EP disclosed
EP-0000492-B1 TRANSPARENT POLYAMIDES AND THEIR USE FOR THE MANUFACTURE OF MOULDS BAYER AG (DE) 1982-06-30 EP disclosed
US-4255560-A Transparent copolyamides from 2,4'-PACM BAYER AKTIENGESELLSCHAFT (DE) 1981-03-10 US disclosed
EP-0001039-B1 TRANSPARENT POLYAMIDE BAYER AG (DE) 1980-09-03 EP disclosed
EP-0012931-A2 Copolyamides based on a mixture of cycloaliphatic amines and moulded articles thereof BAYER AG (DE) 1980-07-09 EP disclosed
US-4205159-A BSI(4-AMINOCYCLOHEXYL) METHANE BAYER AKTIENGESELLSCHAFT (DE) 1980-05-27 US disclosed
US-4195164-A COPOLYAMIDES OF ISOMERIC DIAMINODICYCLOHEXYLMETHANES AND AZELAIC ACID AND OTHER OPTIONAL DIAMINES AND DICARBOXYLIC ACIDS BAYER AKTIENGESELLSCHAFT (DE) 1980-03-25 US disclosed
EP-0001039-A1 Transparent polyamide BAYER AG (DE) 1979-03-21 EP disclosed
EP-0000492-A1 Transparent polyamides and their use for the manufacture of moulds BAYER AG (DE) 1979-02-07 EP disclosed