SCHEMBL28480360

SCHEMBL28480360

CCCCCCCCCCCCCC(=O)c1cc(C(=O)O)c(C(=O)CCCCCCCCCCCCC)cc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.53
FFAR1 O14842 2/20 0.51
PLA2G2A P14555 1/20 0.51
PLA2G5 P39877 1/20 0.51
HSD17B3 P37058 5/20 0.49
GPR84 Q9NQS5 7/20 0.48
PPARG P37231 6/20 0.48
PPARD Q03181 6/20 0.48
PPARA Q07869 6/20 0.48
HDAC11 Q96DB2 5/20 0.48
TSHR P16473 4/20 0.48
ALDH1A1 P00352 2/20 0.48
TLR2 O60603 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
FABP4 P15090 2/20 0.48
PTPN1 P18031 2/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
SLC22A8 Q8TCC7 1/20 0.48
MEN1 O00255 1/20 0.48
ESR1 P03372 1/20 0.48

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
SCHEMBL22852644 0.87 HTT (0.53) HTTHSD17B3PPARAPTPN1
Palmitic Acid SCHEMBL11662922 0.86 GPR84 (0.68) FFAR1GPR84PPARGPPARDPPARA
SCHEMBL20931332 0.84 HTT (0.56) HTTFFAR1PLA2G2APLA2G5HSD17B3
SCHEMBL20931348 0.84 HTT (0.56) HTTFFAR1PLA2G2APLA2G5HSD17B3
SCHEMBL28484657 0.83 HSD17B3 (0.53) HTTHSD17B3TSHR
SCHEMBL28731500 0.83 PLA2G2A (0.51) HTTFFAR1PLA2G2APLA2G5ALDH1A1
SCHEMBL11320754 0.82 HTT (0.51) HTTFFAR1PLA2G2APLA2G5HSD17B3
SCHEMBL2993703 0.81 ALDH1A1 (0.54) HTTHSD17B3ALDH1A1TDP1MEN1
SCHEMBL7043851 0.81 ALDH1A1 (0.54) HTTHSD17B3ALDH1A1TDP1MEN1
SCHEMBL9626282 0.81 ALDH1A1 (0.54) HTTHSD17B3ALDH1A1TDP1MEN1

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-109267167-B Preparation method of antifouling fabric for clothing production 宁波维尼服饰有限公司 2020-11-24 CN claimed
CN-109267167-B Preparation method of antifouling fabric for clothing production 宁波维尼服饰有限公司 2020-11-24 CN disclosed
CN-109267167-B Preparation method of antifouling fabric for clothing production 宁波维尼服饰有限公司 2020-11-24 CN disclosed