SCHEMBL28401337

SCHEMBL28401337

O=c1c2ccccc2oc2c1ccc1ccc(Br)cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.51
MAOA P21397 10/20 0.50
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
GLA P06280 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
PGAM1 P18669 1/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HSD17B10 Q99714 1/20 0.50
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
LMNA P02545 1/20 0.47
NMUR2 Q9GZQ4 2/20 0.46
TNKS O95271 1/20 0.43
TTR P02766 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL22326344 0.90 KMT2A (0.47) PTGS2MAOAKDM4EALDH1A1CYP3A4
SCHEMBL31080981 0.90 KMT2A (0.47) PTGS2MAOAKDM4EALDH1A1CYP3A4
SCHEMBL22337130 0.88 KMT2A (0.48) PTGS2MAOAKDM4EALDH1A1CYP3A4
SCHEMBL18271483 0.87 DYRK1A (0.41) KDM4EALDH1A1MAPTHPGDNMUR2
SCHEMBL12764548 0.84 MAOA (0.61) PTGS2MAOAKDM4EALDH1A1GLA
SCHEMBL490127 0.80 MAOA (0.67) MAOAKDM4EALDH1A1GLACYP3A4
SCHEMBL31397562 0.80 MAOA (0.67) MAOAKDM4EALDH1A1GLACYP3A4
SCHEMBL30284875 0.80 MAOA (0.67) MAOAKDM4EALDH1A1GLACYP3A4
SCHEMBL2592127 0.80 MAOA (0.67) MAOAKDM4EALDH1A1GLACYP3A4
SCHEMBL29595968 0.80 KDM4E (0.44) KDM4EALDH1A1GLACYP3A4MAPT

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-111057037-B Ultraviolet light-promoted synthesis method of xanthone compound 浙江工业大学 2021-07-23 CN disclosed
CN-111057037-A Ultraviolet light-promoted synthesis method of xanthone compound 浙江工业大学 2020-04-24 CN disclosed