SCHEMBL28069016

SCHEMBL28069016

CCc1c(C=CC(=O)Oc2ccccc2)ccc(O)c1O

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.47
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
ALOX5 P09917 2/20 0.42
HTR1A P08908 1/20 0.42
IAPP P10997 3/20 0.40
POLB P06746 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL6668620 0.81 ESR1 (0.48) KMT2AMEN1ALOX5IAPPPOLB
SCHEMBL6678566 0.81 ESR1 (0.48) KMT2AMEN1ALOX5IAPPPOLB
SCHEMBL6063979 0.81 TYR (0.55) MAOBKMT2AMEN1ALDH1A1MAPT
SCHEMBL17691455 0.79 MAOB (0.50) MAOBKMT2AMEN1ALOX5HTR1A
SCHEMBL29009291 0.78 HTR1A (0.48) MAOBKMT2AMEN1ALOX5HTR1A
SCHEMBL27707848 0.75 APP (0.60)
SCHEMBL11827772 0.75 NFKB1 (0.65) MAOBKMT2AMEN1ALOX5HTR1A
SCHEMBL11827763 0.75 NFKB1 (0.65) MAOBKMT2AMEN1ALOX5HTR1A
SCHEMBL29154472 0.74 HPGD (0.54) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL11827066 0.72 POLB (0.58) MAOBKMT2AMEN1ALOX5IAPP

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-105622884-A Organic foam thermal-insulation building material and preparation method thereof SUZHOU FUZHONG PLASTIC CO LTD 2016-06-01 CN disclosed