SCHEMBL11291057

SCHEMBL11291057

O=C1c2ccccc2C(=O)c2c(O)c3c(c(O)c21)CCC(O)C3

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.44
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
MAOA P21397 4/20 0.44
ALDH1A1 P00352 4/20 0.44
DAPK1 P53355 3/20 0.44
HPGD P15428 3/20 0.44
MAPK1 P28482 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
KDM4E B2RXH2 2/20 0.44
CYP3A4 P08684 2/20 0.44
ALOX15 P16050 2/20 0.44
ALOX12 P18054 2/20 0.44
RECQL P46063 2/20 0.44
CYP1B1 Q16678 2/20 0.44
HSD17B10 Q99714 2/20 0.44
TTR P02766 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
CYP1A1 P04798 1/20 0.44
HSPD1 P10809 1/20 0.44

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
SCHEMBL31745135 1.00 MAPT (0.44) MAPTMEN1KMT2AMAOAALDH1A1
SCHEMBL11289616 0.87 MAOA (0.51) MAPTMEN1KMT2AMAOAALDH1A1
SCHEMBL567474 0.82 EGFR (0.54) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL14537729 0.82 EGFR (0.54) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL10584436 0.81 BCL2 (0.48) MAPTMEN1KMT2AMAOAALDH1A1
Hydrochloric Acid SCHEMBL29658548 0.81 EGFR (0.53) MAPTMEN1KMT2AALDH1A1MAPK1
Hydrochloric Acid SCHEMBL7460 0.81 EGFR (0.53) MAPTMEN1KMT2AALDH1A1MAPK1
SCHEMBL27321737 0.81 MEN1 (0.42) MAPTMEN1KMT2AMAOAALDH1A1
SCHEMBL24612662 0.80 MAPT (0.40) MAPTMEN1KMT2AMAOAALDH1A1
SCHEMBL497017 0.80 MAPT (0.40) MAPTMEN1KMT2AMAOAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0007403-B1 5,12-DIHYDROXY-1,2,3,4,6,11-HEXAHYDRO-2,6,11-TRIOXONAPHTHACENES AND THEIR SYNTHESIS THE UNIVERSITY OF KANSAS (US) 1982-11-24 EP claimed
US-4244880-A Anthracycline synthesis UNIVERSITY OF KANSAS ENDOWMENT ASSOCIATION (US) 1981-01-13 US claimed
EP-0007403-A1 5,12-dihydroxy-1,2,3,4,6,11-hexahydro-2,6,11-trioxonaphthacenes and their synthesis THE UNIVERSITY OF KANSAS (US) 1980-02-06 EP claimed
EP-0007403-B1 5,12-DIHYDROXY-1,2,3,4,6,11-HEXAHYDRO-2,6,11-TRIOXONAPHTHACENES AND THEIR SYNTHESIS THE UNIVERSITY OF KANSAS (US) 1982-11-24 EP disclosed
US-4244880-A Anthracycline synthesis UNIVERSITY OF KANSAS ENDOWMENT ASSOCIATION (US) 1981-01-13 US disclosed
EP-0007403-A1 5,12-dihydroxy-1,2,3,4,6,11-hexahydro-2,6,11-trioxonaphthacenes and their synthesis THE UNIVERSITY OF KANSAS (US) 1980-02-06 EP disclosed
US-4021457-A Intermediates for polycyclic quinonoid antibiotics RESEARCH CORPORATION (US) 1977-05-03 US disclosed