SCHEMBL11208428

SCHEMBL11208428

O=C1c2c(O)cccc2Cc2c(Cl)ccc(O)c21

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.66
ALDH1A1 P00352 2/20 0.66
ALOX15 P16050 2/20 0.66
TSHR P16473 2/20 0.66
HSD17B10 Q99714 2/20 0.66
TDP1 Q9NUW8 2/20 0.66
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
USP2 O75604 1/20 0.66
HPN P05981 1/20 0.66
CYP3A4 P08684 1/20 0.66
ALOX5 P09917 1/20 0.66
THRB P10828 1/20 0.66
PTGS1 P23219 1/20 0.66
PDE4A P27815 1/20 0.66
KDR P35968 1/20 0.66
SIRT5 Q9NXA8 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.66
HRH3 Q9Y5N1 1/20 0.66
ELAVL1 Q15717 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
SCHEMBL11205846 0.84 MAPT (0.44) MAPTALDH1A1ALOX15TSHRHSD17B10
SCHEMBL11207521 0.81 MAPT (0.66) MAPTALDH1A1ALOX15TSHRHSD17B10
Anthralin SCHEMBL30013383 0.80 MAPT (1.00) MAPTALDH1A1ALOX15TSHRHSD17B10
Anthralin SCHEMBL3197 0.80 MAPT (1.00) MAPTALDH1A1ALOX15TSHRHSD17B10
Anthralin SCHEMBL29439039 0.80 MAPT (1.00) MAPTALDH1A1ALOX15TSHRHSD17B10
Anthralin SCHEMBL7555831 0.79 MAPT (0.96) MAPTALDH1A1ALOX15TSHRHSD17B10
Anthralin SCHEMBL188254 0.78 MAPT (0.85) MAPTALDH1A1ALOX15TSHRHSD17B10
SCHEMBL11209213 0.77 ALDH1A1 (0.60) MAPTALDH1A1ALOX15TSHRHSD17B10
SCHEMBL11205727 0.77 MAPT (0.60) MAPTALDH1A1ALOX15TSHRHSD17B10
SCHEMBL8756171 0.75 MAPT (0.67) MAPTALDH1A1ALOX15TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0033075-B1 SUBSTITUTED 1.8-DIHYDROXY-9-(10H)-ANTHRACENONES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS Dr. Karl Thomae GmbH (DE) 1983-03-23 EP disclosed
US-4327114-A SKIN DISORDERS BOEHRINGER INGELHEIM GMBH (DE) 1982-04-27 US disclosed
EP-0033075-A1 Substituted 1.8-dihydroxy-9-(10H)-anthracenones, process for their preparation and medicines containing these compounds Dr. Karl Thomae GmbH (DE) 1981-08-05 EP disclosed