SCHEMBL7032709

SCHEMBL7032709

N=C(N)c1ccc(O)c(O)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SELL P14151 1/20 0.50
SELP P16109 1/20 0.50
HDAC1 Q13547 1/20 0.42
PIK3CA P42336 4/20 0.37
LMNA P02545 1/20 0.37
ST14 Q9Y5Y6 1/20 0.36
TERT O14746 1/20 0.35
PTPN22 Q9Y2R2 1/20 0.34
F2 P00734 1/20 0.33
F10 P00742 1/20 0.33
F12 P00748 1/20 0.33
F7 P08709 1/20 0.33
F3 P13726 1/20 0.33
PKM P14618 1/20 0.33
PIM1 P11309 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 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
SCHEMBL3559324 0.83 ALDH1A1 (0.50) LMNATERTF2F10F12
SCHEMBL896864 0.75 SELL (0.50) SELLSELPHDAC1PIK3CATERT
SCHEMBL924425 0.75 SELL (0.62) SELLSELPHDAC1PIK3CATERT
SCHEMBL28012719 0.71 F2 (0.35) LMNAF2F10F12F7
SCHEMBL18732063 0.71 SELL (0.46) SELLSELPHDAC1PIK3CALMNA
SCHEMBL18732057 0.71 SELL (0.46) SELLSELPHDAC1PIK3CALMNA
SCHEMBL1699097 0.71 SELL (0.46) SELLSELPHDAC1PIK3CALMNA
SCHEMBL29373601 0.71 ALDH1A1 (0.57) SELLSELPHDAC1PIK3CALMNA
SCHEMBL338346 0.71 ALDH1A1 (0.57) SELLSELPHDAC1PIK3CALMNA
SCHEMBL3333046 0.70 SELL (0.64) SELLSELPHDAC1PIK3CALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0610444-B1 Use of a polyhydroxybenzamide or a derivative thereof in the manufacture of a medicament for treating viral infectious diseases ELFORD HOWARD L (US) 2003-01-29 EP claimed
US-5366996-A Administering hydroxamic acids ELFORD HOWARD L (US) 1994-11-22 US disclosed
US-5183828-A Ribonucleotide reductase inhibitor and free radical scavenger RIET BARTHOLOMEUS VAN T (US) 1993-02-02 US disclosed
EP-0144396-B1 POLYHYDROXYBENZOIC ACID DERIVATIVES VAN'T RIET, Bartholomeus (US) 1991-01-02 EP disclosed
US-4942253-A INHIBITORS OF RIBONUCLEOTIDE REDUCTASE, ANTITUMOR AGENTS, LEUKEMIA, FREE RADICAL SCAVENGERS RIET BARTHOLOMEUS VAN T (US) 1990-07-17 US disclosed
US-4623659-A RIBONUCLEOTIDE REDUCTASE INHIBITORS RIET BARTHOLOMEUS VAN T (US) 1986-11-18 US disclosed
EP-0144396-A4 POLYHYDROXYBENZOIC ACID DERIVATIVES. RIET BARTHOLOMEUS VAN T (US) 1986-08-21 EP disclosed
EP-0144396-A1 POLYHYDROXYBENZOIC ACID DERIVATIVES. RIET BARTHOLOMEUS VAN T (US) 1985-06-19 EP disclosed
WO-1984004676-A1 POLYHYDROXYBENZOIC ACID DERIVATIVES RIET BARTHOLOMEUS VAN T 1984-12-06 WO disclosed