SCHEMBL28201645

SCHEMBL28201645

NCc1cccc(C(=O)COC(N)=O)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.55
ENPP2 Q13822 1/20 0.42
ALDH1A1 P00352 3/20 0.41
HTT P42858 2/20 0.41
KMT2A Q03164 2/20 0.41
HTR2C P28335 1/20 0.41
MEN1 O00255 1/20 0.41
AGTR1 P30556 1/20 0.41
MAPT P10636 5/20 0.40
CFD P00746 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 2/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.39
TSHR P16473 1/20 0.39
ESR1 P03372 1/20 0.38
ESR2 Q92731 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
SCHEMBL13577866 0.79 LOXL2 (0.62) LOXL2ENPP2ALDH1A1KMT2AHTR2C
SCHEMBL8335580 0.79 NPC1 (0.58) ALDH1A1KMT2AMEN1MAPTTDP1
SCHEMBL28201097 0.78 LOXL2 (0.59) LOXL2ENPP2ALDH1A1HTR2CCFD
SCHEMBL509423 0.77 LOXL2 (0.66) LOXL2ENPP2MAPTCFDTDP1
SCHEMBL29364575 0.77 LOXL2 (0.66) LOXL2ENPP2MAPTCFDTDP1
SCHEMBL8592573 0.77 L3MBTL1 (0.56) ALDH1A1HTTKMT2AMEN1MAPT
SCHEMBL28879863 0.76 LOXL2 (0.57) LOXL2ENPP2ALDH1A1HTR2CCFD
SCHEMBL28879968 0.76 LOXL2 (0.57) LOXL2ENPP2HTR2CCFDNOS1
SCHEMBL2643707 0.76 LOXL2 (0.62) LOXL2ENPP2ALDH1A1HTR2CMAPT
SCHEMBL27280115 0.76 LOXL2 (0.57) LOXL2ENPP2HTR2CCFD

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-107793374-A A kind of preparation method of 2 bromine 1 (3 methoxyphenyl) oxazoles 湖南华腾制药有限公司 2018-03-13 CN disclosed