SCHEMBL7784489

SCHEMBL7784489

CO[C@H]1[C@H](Oc2c(O)c3c(c4cccnc24)C(=O)c2ccccc2C3=O)O[C@@H](C)[C@@H](O)[C@H]1O

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 2/20 0.78
TOP2B Q02880 1/20 0.78
MMP2 P08253 6/20 0.40
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
PTPN1 P18031 1/20 0.33
PRKCQ Q04759 1/20 0.33
SYNJ2 O15056 1/20 0.33
EPHX2 P34913 1/20 0.33
MAPT P10636 3/20 0.32
MITF O75030 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
PGAM1 P18669 1/20 0.32
HPGD P15428 1/20 0.32
EGFR P00533 1/20 0.31

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
SCHEMBL7790424 0.88 TOP2A (1.00) TOP2ATOP2BMMP2MEN1KMT2A
SCHEMBL7794495 0.88 TOP2A (1.00) TOP2ATOP2BMMP2MEN1KMT2A
SCHEMBL7793174 0.88 TOP2A (1.00) TOP2ATOP2BMMP2MEN1KMT2A
SCHEMBL7793975 0.88 TOP2A (1.00) TOP2ATOP2BMMP2MEN1KMT2A
SCHEMBL7784472 0.86 TOP2A (0.63) TOP2ATOP2BMMP2PTPN1MAPT
SCHEMBL7784522 0.84 TOP2A (0.85) TOP2ATOP2BMEN1KMT2APTPN1
SCHEMBL7789968 0.82 TOP2A (0.85) TOP2ATOP2BMEN1KMT2APTPN1
SCHEMBL7793657 0.82 TOP2A (0.85) TOP2ATOP2BMEN1KMT2APTPN1
SCHEMBL7790412 0.80 TOP2A (0.75) TOP2ATOP2BMEN1KMT2AMAPT
SCHEMBL7790409 0.80 TOP2A (0.81) TOP2ATOP2BPTPN1EPHX2NPC1

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
EP-1156056-A1 5-GLYCOSYLOXY-6-HYDROXYNAPHTHO 2,3-f]QUINOLINE-7,12-DIONE HAVING ANTICANCER ACTIVITIES ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 2001-11-21 EP claimed
EP-1156056-A1 5-GLYCOSYLOXY-6-HYDROXYNAPHTHO 2,3-f]QUINOLINE-7,12-DIONE HAVING ANTICANCER ACTIVITIES ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 2001-11-21 EP disclosed