SCHEMBL3783329

SCHEMBL3783329

CCC(O)C(=O)O.CCCC(O)C(=O)O.CCCCC(O)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.67
FFAR1 O14842 1/20 0.67
CA2 P00918 1/20 0.52
MAPK1 P28482 1/20 0.52
CHRM1 P11229 1/20 0.43
AKR1A1 P14550 1/20 0.43
CHRM3 P20309 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
ADRA1A P35348 1/20 0.43
HRH1 P35367 1/20 0.43
DRD3 P35462 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TET2 Q6N021 3/20 0.41
KDM4A O75164 2/20 0.41
KDM4C Q9H3R0 2/20 0.41
KDM2A Q9Y2K7 2/20 0.41

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
SCHEMBL25379921 0.96 GPR84 (0.72) GPR84FFAR1CA2MAPK1TET2
SCHEMBL7092562 0.94 GPR84 (0.75) GPR84FFAR1CA2MAPK1CHRM1
SCHEMBL241631 0.91 GPR84 (0.58) GPR84FFAR1CA2MAPK1CHRM1
SCHEMBL28555 0.89
Hydrogen Peroxide SCHEMBL27840097 0.89 GPR84 (0.82) GPR84FFAR1CA2MAPK1CHRM1
SCHEMBL360108 0.89
SCHEMBL4378353 0.89
SCHEMBL26184961 0.89 GPR84 (0.82) GPR84FFAR1CA2MAPK1CHRM1
SCHEMBL29006047 0.88 GPR84 (0.88) GPR84FFAR1
SCHEMBL29006044 0.88 GPR84 (0.88) GPR84FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110016472-A A kind of DTE immobilization nanosphere and preparation method thereof and the method that D-Psicose is produced based on it 西安交通大学 2019-07-16 CN claimed
CN-102718869-B Microballoon with immobilized presented immune co-stimulation molecules and preparation method of microballoon UNIV XI AN JIAOTONG 2014-08-06 CN claimed
CN-102718869-A Microballoon with immobilized presented immune co-stimulation molecules and preparation method of microballoon UNIV XI AN JIAOTONG 2012-10-10 CN claimed
CN-110016472-A A kind of DTE immobilization nanosphere and preparation method thereof and the method that D-Psicose is produced based on it 西安交通大学 2019-07-16 CN disclosed
CN-109287904-A A kind of preparation method of the fermented fruits and vegetables juice containing D-Psicose 陕西省生物农业研究所 2019-02-01 CN disclosed
CN-105296409-B One plant of engineering bacteria and its construction method and application for producing immobilization alkaline pectase nanosphere 西安交通大学 2018-11-27 CN disclosed
CN-105296409-A Engineering bacterium, construction method and application for producing immobilized alkaline pectinase nano micro-spheres UNIV XI AN JIAOTONG 2016-02-03 CN disclosed
CN-102718869-B Microballoon with immobilized presented immune co-stimulation molecules and preparation method of microballoon UNIV XI AN JIAOTONG 2014-08-06 CN disclosed
CN-102718869-A Microballoon with immobilized presented immune co-stimulation molecules and preparation method of microballoon UNIV XI AN JIAOTONG 2012-10-10 CN disclosed
WO-2010103215-A1 COSMETIC COMPOSITION COMPRISING A COLOURING MATERIAL, COLOURING MATERIAL, AND COSMETIC TREATMENT METHOD L'OREAL (FR) 2010-09-16 WO disclosed