SCHEMBL6067583

SCHEMBL6067583

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.42
AKR1A1 P14550 1/20 0.42
CHRM3 P20309 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
ADRA1A P35348 1/20 0.42
HRH1 P35367 1/20 0.42
DRD3 P35462 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CA2 P00918 1/20 0.37
MAPK1 P28482 1/20 0.37
TSHR P16473 4/20 0.36
CYP3A4 P08684 2/20 0.36
NFKB1 P19838 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
HDAC7 Q8WUI4 1/20 0.33
HDAC8 Q9BY41 1/20 0.33

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
SCHEMBL21269539 0.98 CHRM1 (0.41) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL28314335 0.98 CHRM1 (0.41) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL21269139 0.98 CHRM1 (0.41) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL21268905 0.98 CHRM1 (0.41) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL28315732 0.98 CHRM1 (0.41) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL28316162 0.96 CHRM1 (0.39) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL28657658 0.86 CA2 (0.48) CA2MAPK1SLC1A3SLC1A2SLC1A1
SCHEMBL21269837 0.85 CA2 (0.47) CA2MAPK1SLC1A3SLC1A2SLC1A1
SCHEMBL21269959 0.85 CA2 (0.47) CA2MAPK1SLC1A3SLC1A2SLC1A1
SCHEMBL21268911 0.85 CA2 (0.47) CA2MAPK1SLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113372691-B Resin composition, reinforcing liquid, reinforcing layer, and optical protective film 宁波长阳科技股份有限公司 2022-06-28 CN disclosed
CN-113372691-A Resin composition, reinforcing liquid, reinforcing layer, and optical protective film 宁波长阳科技股份有限公司 2021-09-10 CN disclosed
WO-2006100606-A2 PREPARATION OF BETA-AMINO ACID PRECURSORS VIA INDIUM (III) MEDIATED MARKOVNIKOV ADDITION AND KNOEVENAGEL CONDENSATION WARNER-LAMBERT COMPANY LLC (US) 2006-09-28 WO disclosed
EP-0019578-B1 PIPERIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND POLYMER COMPOSITIONS CONTAINING THEM Chimosa Chimica Organica S.p.A. (IT) 1983-03-30 EP disclosed
EP-0019578-A1 Piperidine derivatives, process for preparing them and polymer compositions containing them Chimosa Chimica Organica S.p.A. (IT) 1980-11-26 EP disclosed