SCHEMBL28375677

SCHEMBL28375677

CCCCCC(CCCCCCCC(=O)O)(OOC(C)(C)C)OOC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.57
PPARG P37231 7/20 0.57
PPARD Q03181 7/20 0.57
PPARA Q07869 7/20 0.57
HDAC11 Q96DB2 5/20 0.57
TSHR P16473 4/20 0.57
PTPN1 P18031 3/20 0.57
FABP4 P15090 3/20 0.57
ALDH1A1 P00352 2/20 0.57
TLR2 O60603 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
KMT2A Q03164 2/20 0.57
ALOX15 P16050 2/20 0.57
HSD17B10 Q99714 2/20 0.57
SLC22A6 Q4U2R8 1/20 0.57
SLC22A8 Q8TCC7 1/20 0.57
MEN1 O00255 1/20 0.57
ESR1 P03372 1/20 0.57
PDE4A P27815 1/20 0.57
PDE3A Q14432 1/20 0.57

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
SCHEMBL25389999 0.92 AKR1B1 (0.45) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL19712139 0.90 AKR1B1 (0.47) GPR84PPARGPPARDPPARAHDAC11
Dodecanoate SCHEMBL27336590 0.89 GPR84 (0.71) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL27797479 0.89 GPR84 (0.71) GPR84PPARGPPARDPPARAHDAC11
Hexanoate SCHEMBL9341885 0.88 AKR1B1 (0.70) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL27784721 0.83 LMNA (0.37) GPR84PPARGPPARDPPARAHDAC11
Valeric Acid SCHEMBL2468011 0.82 AKR1B1 (0.58) GPR84PPARGPPARDPPARAHDAC11
Valeric Acid SCHEMBL27265526 0.82 AKR1B1 (0.58) GPR84PPARGPPARDPPARAHDAC11
Azelaic Acid SCHEMBL27377315 0.82 TSHR (0.60) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL9814516 0.80 TSHR (0.48) GPR84PPARGPPARDPPARAHDAC11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107580614-B Use of acrylate rubbers with improved low-temperature properties and oil resistance for producing curable mixtures and cured products 阿朗新科德国有限责任公司 2021-05-14 CN disclosed
CN-111492002-A Cured HNBR products having improved hot air resistance 阿朗新科德国有限责任公司 2020-08-04 CN disclosed
CN-108602989-B Hydrogenated nitrile-butadiene-PEG-acrylate copolymers 阿朗新科德国有限责任公司 2020-04-14 CN disclosed