SCHEMBL4247193

SCHEMBL4247193

C=CCC=CC(=O)C=CCC=C

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.32
ABCC4 O15439 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 4/20 0.32
GABRR1 P24046 2/20 0.32
GABRR2 P28476 2/20 0.32
BLM P54132 2/20 0.32
GABRR3 A8MPY1 1/20 0.32
APEX1 P27695 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TP53 P04637 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30
EGLN3 Q9H6Z9 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
SCHEMBL10457722 0.87
SCHEMBL13493080 0.82
SCHEMBL1082001 0.82
SCHEMBL5606321 0.82
SCHEMBL9722167 0.80
SCHEMBL9722162 0.80
SCHEMBL12157627 0.78
SCHEMBL1047044 0.78
SCHEMBL11283505 0.78
SCHEMBL2481651 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050209100-A1 Optically active support materials, their method of preparation and their uses EKA CHEMICALS (SE) 2005-09-22 US claimed
CN-114634465-A Sulfonyl piperazine-containing pentadiene ketone derivative and preparation method and application thereof 贵州大学 2022-06-17 CN disclosed
CN-110128408-B Quinoxaline-containing pentadiene ketoxime ether compounds and preparation method and application thereof 贵州大学 2022-03-25 CN disclosed
CN-110078721-B Triazine-containing pentadiene ketone compound and preparation method and application thereof 贵州大学 2022-03-25 CN disclosed
CN-109721559-B 1, 4-pentadiene-3-ketone derivative containing thioether triazole, preparation method and application 贵州大学 2022-02-15 CN disclosed
CN-108822045-B Quinazoline-containing 1, 4-pentadiene-3-ketoxime ether derivative, preparation method and application 贵州大学 2021-06-08 CN disclosed
CN-108864188-B Phosphite ester-containing 1, 4-pentadiene-3-ketone derivative, and preparation method and application thereof 贵州大学 2020-06-23 CN disclosed
EP-2697197-B1 PYRROLO SULFONAMIDE COMPOUNDS FOR MODULATION OF ORPHAN NUCLEAR RECEPTOR RAR-RELATED ORPHAN RECEPTOR-GAMMA (RORGAMMA, NR1F3) ACTIVITY AND FOR THE TREATMENT OF CHRONIC INFLAMMATORY AND AUTOIMMUNE DISEASES PHENEX PHARMACEUTICALS AG (DE) 2015-06-03 EP disclosed
US-7597804-B2 Optically active support materials, their method of preparation and their uses EKA CHEMICALS (SE) 2009-10-06 US disclosed
US-20050209100-A1 Optically active support materials, their method of preparation and their uses EKA CHEMICALS (SE) 2005-09-22 US disclosed
US-6020491-A Monomeric and polymeric cyclic amine and N-halamine compounds AUBURN UNIVERSITY (US) 2000-02-01 US disclosed
US-5094930-A ELECTROPHOTOGRAPHIC PHOTORECEPTOR KONICA CORPORATION (JP) 1992-03-10 US disclosed