SCHEMBL7633731

SCHEMBL7633731

CCCCOC(=O)C(CCCC)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
CA2 P00918 2/20 0.47
ATM Q13315 1/20 0.47
MAPK1 P28482 1/20 0.47
HCAR2 Q8TDS4 2/20 0.46
TSHR P16473 2/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
CA1 P00915 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GPR84 Q9NQS5 3/20 0.41
NAAA Q02083 1/20 0.41
FFAR1 O14842 1/20 0.41
SLC1A3 P43003 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL251336 0.94 NAAA (0.48) ALDH1A1CA2MAPK1HCAR2TSHR
SCHEMBL28070253 0.92 MAPT (0.55) ALDH1A1ATMHCAR2MAPTGPR84
SCHEMBL10520107 0.92 ALDH1A1 (0.50) ALDH1A1CA2ATMMAPK1HCAR2
SCHEMBL28447565 0.92 CA2 (0.47) ALDH1A1CA2ATMMAPK1HCAR2
SCHEMBL2276735 0.91 ALDH1A1 (0.54) ALDH1A1CA2ATMMAPK1HCAR2
SCHEMBL2123199 0.89 ALDH1A1 (0.44) ALDH1A1CA2ATMMAPK1HCAR2
SCHEMBL25185273 0.88 MAPT (0.55) HCAR2TSHRMAPTGPR84NAAA
SCHEMBL10523806 0.88 MAPT (0.55) HCAR2TSHRMAPTGPR84NAAA
SCHEMBL4949251 0.88 MAPT (0.55) HCAR2TSHRMAPTGPR84NAAA
SCHEMBL28651223 0.88 ALDH1A1 (0.50) ALDH1A1CA2ATMMAPK1HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11787975-B2 Cyanoacrylic adhesive compositions with improved resistance to high temperatures PERMABOND ENGINEERING ADHESIVES LTD (GB) 2023-10-17 US disclosed
CN-111205463-B Polysiloxane skeleton polymer, photosensitive resin composition, pattern forming method and manufacturing of optical semiconductor device 信越化学工业株式会社 2023-02-14 CN disclosed
CN-112272687-B Phosphate amine salt composition, phosphate amine salt flame retardant composition, flame-retardant synthetic resin composition containing same, and molded article thereof 株式会社ADEKA 2022-06-10 CN disclosed
US-20200407596-A1 CYANOACRYLIC ADHESIVE COMPOSITIONS WITH IMPROVED RESISTANCE TO HIGH TEMPERATURES PERMABOND ENGINEERING ADHESIVES LTD (GB) 2020-12-31 US disclosed
CN-102026966-B Novel amino acid derivatives, preparation method and therapeutic use thereof PHARMALEADS 2014-02-12 CN disclosed
CN-102026966-A Novel amino acid derivatives, preparation method and therapeutic use thereof PHARMALEADS 2011-04-20 CN disclosed
EP-1003707-B1 MALONIC ACID AND ESTERS THEREOF TRIKEM SA (BR) 2002-12-04 EP disclosed
US-6395931-B1 REACTION OF CYANOACETIC ACID WITH HYDROCHLORIC ACID TO FORM MALONIC ACID, SEPARATION OF ACETIC ACID BY-PRODUCTS AND PURIFICATION TRIKEM S.A. (BR) 2002-05-28 US disclosed
EP-1003707-A1 MALONIC ACID AND ESTERS THEREOF Trikem S.A. (BR) 2000-05-31 EP disclosed
WO-1999008988-A1 MALONIC ACID AND ESTERS THEREOF TRIKEM S.A. (BR) 1999-02-25 WO disclosed
US-5221760-A Intermediates, leukotriene antagonists BAYER AKTIENGESELLSCHAFT (DE) 1993-06-22 US disclosed
EP-0341551-B1 ALKENOIC ACID DERIVATIVES BAYER AG (DE) 1992-04-01 EP disclosed
US-5041638-A Leucotriene antagonist; treatment of respiratory system disorders, cardiovascular disorders BAYER AKTIENGESELLSCHAFT (DE) 1991-08-20 US disclosed
EP-0341551-A1 Alkenoic acid derivatives BAYER AG (DE) 1989-11-15 EP disclosed