SCHEMBL3841847

SCHEMBL3841847

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 2/20 0.38
CHRM1 P11229 1/20 0.38
AKR1A1 P14550 1/20 0.38
CHRM3 P20309 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
ADRA1A P35348 1/20 0.38
HRH1 P35367 1/20 0.38
DRD3 P35462 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 4/20 0.32
NFKB1 P19838 3/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
BLM P54132 1/20 0.32
MEN1 O00255 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL3229724 0.83 TSHR (0.32) SLC6A3TSHRNFKB1SLC6A2SLC6A4
SCHEMBL3433396 0.81 CHRM1 (0.33) SLC6A3CHRM1AKR1A1CHRM3HTR2A
SCHEMBL14877361 0.81 SLC6A2 (0.33) SLC6A3TSHRNFKB1SLC6A2SLC6A4
SCHEMBL323329 0.80
SCHEMBL29957730 0.80
SCHEMBL29958079 0.80
SCHEMBL28207855 0.78 SLC6A3 (0.46) SLC6A3CHRM1AKR1A1CHRM3HTR2A
SCHEMBL4446962 0.78 SLC6A3 (0.39) SLC6A3CHRM1AKR1A1CHRM3HTR2A
SCHEMBL18606076 0.76
SCHEMBL7514673 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268930-B1 Method for making a coating composition BASF SE (DE) 2009-09-09 EP claimed
EP-1268930-A1 COATING COMPOSITION, ITS USE, AND A METHOD FOR MAKING IT Raisio Chemicals Ltd. (FI) 2003-01-02 EP claimed
WO-2001059215-A1 COATING COMPOSITION, ITS USE, AND A METHOD FOR MAKING IT RAISIO CHEMICALS LTD (FI) 2001-08-16 WO claimed
CN-111133071-A Water-based adhesive composition and method of making same 罗门哈斯公司 2020-05-08 CN disclosed
CN-108602242-B 3-D printing surface 3M创新有限公司 2020-04-03 CN disclosed
EP-1268930-B1 Method for making a coating composition BASF SE (DE) 2009-09-09 EP disclosed
EP-1268930-A1 COATING COMPOSITION, ITS USE, AND A METHOD FOR MAKING IT Raisio Chemicals Ltd. (FI) 2003-01-02 EP disclosed
WO-2001059215-A1 COATING COMPOSITION, ITS USE, AND A METHOD FOR MAKING IT RAISIO CHEMICALS LTD (FI) 2001-08-16 WO disclosed
US-4777497-A Ink jet printing head having a flexible film covered ink supply chamber KONISHIROKU PHOTO INDUSTRY CO., LTD (JP) 1988-10-11 US disclosed