Questiomycin B

Questiomycin B

SCHEMBL4623183

Nc1cc(C(c2ccc(O)c(N)c2)(C(F)(F)F)C(F)(F)F)ccc1O.Nc1ccccc1O.Nc1ccccc1O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.52
TSHR P16473 1/20 0.52
ALDH1A1 P00352 10/20 0.50
GAA P10253 7/20 0.50
MAPT P10636 5/20 0.50
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
PKM P14618 2/20 0.50
RECQL P46063 2/20 0.50
ESR1 P03372 2/20 0.42
ESR2 Q92731 2/20 0.42
HSD17B10 Q99714 5/20 0.42
KDM4E B2RXH2 4/20 0.42
ALOX12 P18054 3/20 0.42
HPGD P15428 3/20 0.42
HTT P42858 2/20 0.42
USP2 O75604 1/20 0.42
LMNA P02545 1/20 0.42
HSP90AA1 P07900 1/20 0.42
CHEK1 O14757 1/20 0.39

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
SCHEMBL29379543 0.91 ALDH1A1 (0.59) ALOX15ALDH1A1GAAMAPTMEN1
SCHEMBL29360962 0.91 ALDH1A1 (0.59) ALOX15ALDH1A1GAAMAPTMEN1
SCHEMBL26579 0.91 ALDH1A1 (0.59) ALOX15ALDH1A1GAAMAPTMEN1
Hydrochloric Acid SCHEMBL8977755 0.89 ALDH1A1 (0.57) ALOX15ALDH1A1GAAMAPTMEN1
Ammonia Solution, Strong SCHEMBL48746 0.89 ALDH1A1 (0.57) ALOX15ALDH1A1GAAMAPTMEN1
SCHEMBL4295432 0.88 ALDH1A1 (0.52) ALOX15TSHRALDH1A1GAAMAPT
SCHEMBL9221025 0.83 MAPK1 (0.50) ALOX15TSHRALDH1A1GAAMAPT
SCHEMBL13878423 0.83 ALDH1A1 (0.50) ALOX15ALDH1A1GAAMAPTMEN1
SCHEMBL28561388 0.83 ALDH1A1 (0.50) ALOX15ALDH1A1GAAMAPTMEN1
SCHEMBL14665668 0.83 ALDH1A1 (0.55) ALOX15ALDH1A1GAAMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1654311-B1 CURABLE PERFLUOROELASTOMER COMPOSITION DUPONT DOW ELASTOMERS LLC (US) 2007-06-20 EP claimed
EP-0905169-B1 Precursors of polybenzoxazoles and polybenzothiazoles INFINEON TECHNOLOGIES AG (DE) 2008-04-02 EP disclosed
EP-0905169-A2 Precursors of polybenzoxazoles and polybenzothiazoles SIEMENS AKTIENGESELLSCHAFT (DE) 1999-03-31 EP disclosed
US-5789509-A HEAT TREATING TO DECARBOXYLATE POLYMER; DECREASED VISCOSITY; CAN BE MADE CURABLE. E. I. DU PONT DE NEMOURS AND COMPANY (US) 1998-08-04 US disclosed