SCHEMBL28118045

SCHEMBL28118045

NCc1cccc(C(O)=Cc2ccccc2O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 3/20 0.47
ENPP2 Q13822 1/20 0.44
CFD P00746 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
PTPN1 P18031 1/20 0.38
TSHR P16473 2/20 0.37
PNMT P11086 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
SCHEMBL28117631 0.79 MAPT (0.50) KDM4EALDH1A1GAAMAPTHPGD
SCHEMBL28117784 0.76 NPC1 (0.45) KDM4EALDH1A1GAAMAPTHPGD
SCHEMBL28118080 0.76 KDM1A (0.54) KDM4EALDH1A1POLBMAPTTSHR
Salicyladehyde SCHEMBL29118303 0.75 TRIM24 (0.67) LOXL2ENPP2KDM4EALDH1A1POLB
SCHEMBL28117629 0.72 MAPK10 (0.49) ALDH1A1HPGDPRSS1PRSS2PRSS3
SCHEMBL27971364 0.70 LOXL2 (0.49) LOXL2ENPP2CFDPRSS1PRSS2
SCHEMBL28151612 0.69 LOXL2 (0.56) LOXL2ENPP2CFDALDH1A1PRSS1
SCHEMBL2900640 0.69 ATM (0.63) LOXL2ENPP2CFDALDH1A1TDP1
SCHEMBL12696354 0.69 LOXL2 (0.60) LOXL2ENPP2CFDALDH1A1PRSS1
SCHEMBL31500915 0.69 FOLH1 (0.66) LOXL2ENPP2CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106278831-B The preparation method and intermediate of 2- phenethyl phenol derivatives and its intermediate 联化科技(台州)有限公司 2019-08-09 CN disclosed
CN-106278831-A 2-phenethyl phenol derivatives and the preparation method of intermediate thereof and intermediate 联化科技(台州)有限公司 2017-01-04 CN disclosed