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Sugi Predict / Compounds / SCHEMBL7784483

SCHEMBL7784483

SCHEMBL7784483

C[C@@H]1O[C@H](Oc2c(OC(=O)CCN)c3c(c4cccnc24)C(=O)c2ccccc2C3=O)[C@@H](F)[C@H](OC(=O)CCN)[C@@H]1OC(=O)CCN

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 1/20 0.58
▸ TOP2B Q02880 1/20 0.58
▸ TDP1 Q9NUW8 2/20 0.33

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
SCHEMBL7790550 0.91 TOP2A (0.71) TOP2ATOP2BTDP1
SCHEMBL7790450 0.91 TOP2A (0.71) TOP2ATOP2BTDP1
SCHEMBL7790425 0.91 TOP2A (0.71) TOP2ATOP2BTDP1
SCHEMBL7794477 0.87 TOP2A (0.51) TOP2ATOP2BTDP1
SCHEMBL7793233 0.86 TOP2A (0.75) TOP2ATOP2BTDP1
SCHEMBL7793983 0.85 TOP2A (0.76) TOP2ATOP2BTDP1
SCHEMBL7784478 0.85 TOP2A (0.76) TOP2ATOP2BTDP1
SCHEMBL7789896 0.80 TOP2A (0.73) TOP2ATOP2BTDP1
SCHEMBL7790428 0.80 TOP2A (0.73) TOP2ATOP2BTDP1
SCHEMBL7784492 0.80 TOP2A (0.73) TOP2ATOP2BTDP1

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