SCHEMBL28115877

SCHEMBL28115877

C[C](C)Cc1ccc(C(=O)O)c(O)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.57
ALDH1A1 P00352 4/20 0.52
TSHR P16473 2/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
KDM4E B2RXH2 4/20 0.48
MAPT P10636 3/20 0.48
GAA P10253 3/20 0.48
HPGD P15428 3/20 0.48
HSD17B10 Q99714 3/20 0.48
ESR2 Q92731 2/20 0.48
POLB P06746 2/20 0.48
CYP3A4 P08684 1/20 0.48
PTPN1 P18031 1/20 0.48
RGS12 O14924 1/20 0.48
LMNA P02545 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
SCHEMBL7852526 0.85 CFD (0.46) PPARAALDH1A1KDM4EMAPTHPGD
SCHEMBL14879765 0.85 GAA (0.68) PPARAALDH1A1TSHRCA12CA1
SCHEMBL4960098 0.81 PPARA (0.76) PPARAALDH1A1TSHRCA12CA1
SCHEMBL13209792 0.81 ALDH1A1 (0.53) PPARAALDH1A1TSHRCA12CA1
SCHEMBL2126940 0.81 PPARA (0.65) PPARAALDH1A1TSHRCA12CA1
SCHEMBL9470534 0.80 ALDH1A1 (0.52) PPARAALDH1A1TSHRCA12CA1
SCHEMBL2837159 0.79 ALDH1A1 (0.57) PPARAALDH1A1TSHRCA12CA1
SCHEMBL1401513 0.79 ALDH1A1 (0.57) PPARAALDH1A1TSHRCA12CA1
SCHEMBL11108409 0.78 HPGD (0.63) PPARAALDH1A1TSHRCA2KDM4E
SCHEMBL1401449 0.77 PPARA (0.56) PPARAALDH1A1TSHRCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106258252-A A kind of biomass straw pulverizes briquetting all-in-one and method of work thereof 江苏建筑职业技术学院 2017-01-04 CN claimed
CN-105400078-A Illumination ageing-resistant reinforced PP plastic and preparation method thereof SHANGHAI HAN'S MOLDING CO LTD 2016-03-16 CN claimed
CN-106305323-A Straightening device for preventing garden trees from obliquely growing and work method thereof 徐州工程学院 2017-01-11 CN disclosed
CN-106258252-A A kind of biomass straw pulverizes briquetting all-in-one and method of work thereof 江苏建筑职业技术学院 2017-01-04 CN disclosed
CN-105400078-A Illumination ageing-resistant reinforced PP plastic and preparation method thereof SHANGHAI HAN'S MOLDING CO LTD 2016-03-16 CN disclosed