SCHEMBL29109673

SCHEMBL29109673

C=C(C)C(=O)OC.CCC=C(CCCCCC)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.44
ALDH1A1 P00352 3/20 0.43
APEX1 P27695 2/20 0.41
HAO1 Q9UJM8 1/20 0.38
THRB P10828 1/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
PGGT1B P53609 1/20 0.38
POLB P06746 1/20 0.38
POLA1 P09884 1/20 0.38
GPR84 Q9NQS5 7/20 0.37
PPARG P37231 6/20 0.37
PPARD Q03181 6/20 0.37
PPARA Q07869 6/20 0.37
HDAC11 Q96DB2 5/20 0.37
TLR2 O60603 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
FABP4 P15090 2/20 0.37
PTPN1 P18031 2/20 0.37
SLC22A6 Q4U2R8 1/20 0.37

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
SCHEMBL10906263 0.91 TSHR (0.38) TSHRALDH1A1APEX1HAO1THRB
Methacrylic Acid SCHEMBL18587036 0.88 FNTA (0.44) TSHRALDH1A1THRBFNTAFNTB
Styrene SCHEMBL2136843 0.87 TDP1 (0.41) TSHRALDH1A1APEX1PPARGTDP1
SCHEMBL10781201 0.86 TSHR (0.65) TSHRAPEX1THRBFNTAFNTB
SCHEMBL2244179 0.84 APEX1 (0.37) TSHRALDH1A1APEX1HAO1THRB
SCHEMBL8568253 0.83 ALDH1A1 (0.43) TSHRALDH1A1APEX1HAO1THRB
SCHEMBL5077544 0.83 GPR84 (0.52) TSHRALDH1A1APEX1POLBGPR84
SCHEMBL1864621 0.83 GPR84 (0.52) TSHRALDH1A1APEX1POLBGPR84
SCHEMBL30900564 0.83 GPR84 (0.52) TSHRALDH1A1APEX1POLBGPR84
SCHEMBL30595585 0.83 GPR84 (0.52) TSHRALDH1A1APEX1POLBGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113574128-B Pigment dispersion comprising silane modified colloidal silica particles and water-soluble thickening polymer 诺力昂化学品国际有限公司 2023-11-21 CN disclosed